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Applied Data Analysis and Machine Learning
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About the course
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Teachers and Grading
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Review of Statistics with Resampling Techniques and Linear Algebra
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1. Elements of Probability Theory and Statistical Data Analysis
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<a class="reference internal" href="linalg.html">
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2. Linear Algebra, Handling of Arrays and more Python Features
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<p aria-level="2" class="caption" role="heading">
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From Regression to Support Vector Machines
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</span>
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3. Linear Regression
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<a class="reference internal" href="chapter2.html">
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4. Ridge and Lasso Regression
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</a>
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<a class="reference internal" href="chapter3.html">
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5. Resampling Methods
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</a>
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<a class="reference internal" href="chapter4.html">
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6. Logistic Regression
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</a>
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<li class="toctree-l1">
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<a class="reference internal" href="chapteroptimization.html">
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7. Optimization, the central part of any Machine Learning algortithm
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</a>
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<a class="reference internal" href="chapter5.html">
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8. Support Vector Machines, overarching aims
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</a>
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</ul>
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<p aria-level="2" class="caption" role="heading">
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<span class="caption-text">
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Decision Trees, Ensemble Methods and Boosting
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</span>
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9. Decision trees, overarching aims
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</a>
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<li class="toctree-l1">
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<a class="reference internal" href="chapter7.html">
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10. Ensemble Methods: From a Single Tree to Many Trees and Extreme Boosting, Meet the Jungle of Methods
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</a>
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</li>
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</ul>
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<p aria-level="2" class="caption" role="heading">
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<span class="caption-text">
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Dimensionality Reduction
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<a class="reference internal" href="chapter8.html">
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11. Basic ideas of the Principal Component Analysis (PCA)
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</a>
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<a class="reference internal" href="clustering.html">
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12. Clustering and Unsupervised Learning
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</a>
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<p aria-level="2" class="caption" role="heading">
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<span class="caption-text">
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Deep Learning Methods
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<a class="current reference internal" href="#">
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13. Neural networks
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</a>
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<a class="reference internal" href="chapter10.html">
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14. Building a Feed Forward Neural Network
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</a>
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<li class="toctree-l1">
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<a class="reference internal" href="chapter11.html">
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15. Solving Differential Equations with Deep Learning
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</a>
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<a class="reference internal" href="chapter12.html">
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16. Convolutional Neural Networks
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<a class="reference internal" href="chapter13.html">
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17. Recurrent neural networks: Overarching view
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Weekly material, notes and exercises
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Exercises week 34
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Week 34: Introduction to the course, Logistics and Practicalities
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Exercises week 35
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Week 35: From Ordinary Linear Regression to Ridge and Lasso Regression
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Exercises week 36
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Week 36: Statistical interpretation of Linear Regression and Resampling techniques
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Exercises week 37
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Week 37: Statistical interpretations and Resampling Methods
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<a class="reference internal" href="exercisesweek38.html">
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Exercises week 38
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</a>
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Week 38: Logistic Regression and Optimization
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<li class="toctree-l1">
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<a class="reference internal" href="exercisesweek39.html">
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Exercises week 39
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Week 39: Optimization and Gradient Methods
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<li class="toctree-l1">
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<a class="reference internal" href="week40.html">
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Week 40: Gradient descent methods (continued) and start Neural networks
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<li class="toctree-l1">
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<a class="reference internal" href="exercisesweek41.html">
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Exercises week 41
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<a class="reference internal" href="week41.html">
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Week 41 Neural networks and constructing a neural network code
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<li class="toctree-l1">
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<a class="reference internal" href="exercisesweek42.html">
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Exercises week 42
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<a class="reference internal" href="week42.html">
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Week 42 Constructing a Neural Network code with introduction to Tensor flow
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Exercises weeks 43 and 44
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<li class="toctree-l1">
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<a class="reference internal" href="week43.html">
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Week 43: Deep Learning: Constructing a Neural Network code and solving differential equations
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</a>
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</li>
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<li class="toctree-l1">
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<a class="reference internal" href="week44.html">
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Week 44, Convolutional Neural Networks (CNN)
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</a>
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</li>
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<li class="toctree-l1">
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<a class="reference internal" href="week45.html">
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Week 45, Recurrent Neural Networks
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<li class="toctree-l1">
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<a class="reference internal" href="week46.html">
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Week 46: Decision Trees, Ensemble methods and Random Forests
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<a class="reference internal" href="week47.html">
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Week 47: From Decision Trees to Ensemble Methods, Random Forests and Boosting Methods and Summary of Course
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Projects
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Project 1 on Machine Learning, deadline October 9 (midnight), 2023
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</a>
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</li>
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<li class="toctree-l1">
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<a class="reference internal" href="project2.html">
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Project 2 on Machine Learning, deadline November 17 (Midnight)
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</a>
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<li class="toctree-l1">
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<a class="reference internal" href="project3.html">
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Project 3 on Machine Learning, deadline December 18 (midnight), 2023
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13.1. Feed-forward neural networks
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<a class="reference internal nav-link" href="#convolutional-neural-network">
|
||
13.2. Convolutional Neural Network
|
||
</a>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#recurrent-neural-networks">
|
||
13.3. Recurrent neural networks
|
||
</a>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#other-types-of-networks">
|
||
13.4. Other types of networks
|
||
</a>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#multilayer-perceptrons">
|
||
13.5. Multilayer perceptrons
|
||
</a>
|
||
<ul class="nav section-nav flex-column">
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#matrix-vector-notation-and-activation">
|
||
13.5.1. Matrix-vector notation and activation
|
||
</a>
|
||
</li>
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#activation-functions">
|
||
13.5.2. Activation functions
|
||
</a>
|
||
</li>
|
||
</ul>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#the-multilayer-perceptron-mlp">
|
||
13.6. The multilayer perceptron (MLP)
|
||
</a>
|
||
<ul class="nav section-nav flex-column">
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#from-one-to-many-layers-the-universal-approximation-theorem">
|
||
13.6.1. From one to many layers, the universal approximation theorem
|
||
</a>
|
||
</li>
|
||
</ul>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#deriving-the-back-propagation-code-for-a-multilayer-perceptron-model">
|
||
13.7. Deriving the back propagation code for a multilayer perceptron model
|
||
</a>
|
||
<ul class="nav section-nav flex-column">
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#derivatives-and-the-chain-rule">
|
||
13.7.1. Derivatives and the chain rule
|
||
</a>
|
||
</li>
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#bringing-it-together-first-back-propagation-equation">
|
||
13.7.2. Bringing it together, first back propagation equation
|
||
</a>
|
||
</li>
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#final-back-propagating-equation">
|
||
13.7.3. Final back propagating equation
|
||
</a>
|
||
</li>
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#setting-up-the-back-propagation-algorithm">
|
||
13.7.4. Setting up the Back propagation algorithm
|
||
</a>
|
||
</li>
|
||
</ul>
|
||
</li>
|
||
</ul>
|
||
|
||
</nav>
|
||
</div>
|
||
</div>
|
||
</div>
|
||
<div id="main-content" class="row">
|
||
<div class="col-12 col-md-9 pl-md-3 pr-md-0">
|
||
<!-- Table of contents that is only displayed when printing the page -->
|
||
<div id="jb-print-docs-body" class="onlyprint">
|
||
<h1>Neural networks</h1>
|
||
<!-- Table of contents -->
|
||
<div id="print-main-content">
|
||
<div id="jb-print-toc">
|
||
|
||
<div>
|
||
<h2> Contents </h2>
|
||
</div>
|
||
<nav aria-label="Page">
|
||
<ul class="visible nav section-nav flex-column">
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#feed-forward-neural-networks">
|
||
13.1. Feed-forward neural networks
|
||
</a>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#convolutional-neural-network">
|
||
13.2. Convolutional Neural Network
|
||
</a>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#recurrent-neural-networks">
|
||
13.3. Recurrent neural networks
|
||
</a>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#other-types-of-networks">
|
||
13.4. Other types of networks
|
||
</a>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#multilayer-perceptrons">
|
||
13.5. Multilayer perceptrons
|
||
</a>
|
||
<ul class="nav section-nav flex-column">
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#matrix-vector-notation-and-activation">
|
||
13.5.1. Matrix-vector notation and activation
|
||
</a>
|
||
</li>
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#activation-functions">
|
||
13.5.2. Activation functions
|
||
</a>
|
||
</li>
|
||
</ul>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#the-multilayer-perceptron-mlp">
|
||
13.6. The multilayer perceptron (MLP)
|
||
</a>
|
||
<ul class="nav section-nav flex-column">
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#from-one-to-many-layers-the-universal-approximation-theorem">
|
||
13.6.1. From one to many layers, the universal approximation theorem
|
||
</a>
|
||
</li>
|
||
</ul>
|
||
</li>
|
||
<li class="toc-h2 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#deriving-the-back-propagation-code-for-a-multilayer-perceptron-model">
|
||
13.7. Deriving the back propagation code for a multilayer perceptron model
|
||
</a>
|
||
<ul class="nav section-nav flex-column">
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#derivatives-and-the-chain-rule">
|
||
13.7.1. Derivatives and the chain rule
|
||
</a>
|
||
</li>
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#bringing-it-together-first-back-propagation-equation">
|
||
13.7.2. Bringing it together, first back propagation equation
|
||
</a>
|
||
</li>
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#final-back-propagating-equation">
|
||
13.7.3. Final back propagating equation
|
||
</a>
|
||
</li>
|
||
<li class="toc-h3 nav-item toc-entry">
|
||
<a class="reference internal nav-link" href="#setting-up-the-back-propagation-algorithm">
|
||
13.7.4. Setting up the Back propagation algorithm
|
||
</a>
|
||
</li>
|
||
</ul>
|
||
</li>
|
||
</ul>
|
||
|
||
</nav>
|
||
</div>
|
||
</div>
|
||
</div>
|
||
|
||
<div>
|
||
|
||
<div class="tex2jax_ignore mathjax_ignore section" id="neural-networks">
|
||
<h1><span class="section-number">13. </span>Neural networks<a class="headerlink" href="#neural-networks" title="Permalink to this headline">¶</a></h1>
|
||
<p>Artificial neural networks are computational systems that can learn to
|
||
perform tasks by considering examples, generally without being
|
||
programmed with any task-specific rules. It is supposed to mimic a
|
||
biological system, wherein neurons interact by sending signals in the
|
||
form of mathematical functions between layers. All layers can contain
|
||
an arbitrary number of neurons, and each connection is represented by
|
||
a weight variable.</p>
|
||
<p>The field of artificial neural networks has a long history of
|
||
development, and is closely connected with the advancement of computer
|
||
science and computers in general. A model of artificial neurons was
|
||
first developed by McCulloch and Pitts in 1943 to study signal
|
||
processing in the brain and has later been refined by others. The
|
||
general idea is to mimic neural networks in the human brain, which is
|
||
composed of billions of neurons that communicate with each other by
|
||
sending electrical signals. Each neuron accumulates its incoming
|
||
signals, which must exceed an activation threshold to yield an
|
||
output. If the threshold is not overcome, the neuron remains inactive,
|
||
i.e. has zero output.</p>
|
||
<p>This behaviour has inspired a simple mathematical model for an artificial neuron.</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="artificialNeuron"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
y = f\left(\sum_{i=1}^n w_ix_i\right) = f(u)
|
||
\label{artificialNeuron} \tag{1}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>Here, the output <span class="math notranslate nohighlight">\(y\)</span> of the neuron is the value of its activation function, which have as input
|
||
a weighted sum of signals <span class="math notranslate nohighlight">\(x_i, \dots ,x_n\)</span> received by <span class="math notranslate nohighlight">\(n\)</span> other neurons.</p>
|
||
<p>Conceptually, it is helpful to divide neural networks into four
|
||
categories:</p>
|
||
<ol class="simple">
|
||
<li><p>general purpose neural networks for supervised learning,</p></li>
|
||
<li><p>neural networks designed specifically for image processing, the most prominent example of this class being Convolutional Neural Networks (CNNs),</p></li>
|
||
<li><p>neural networks for sequential data such as Recurrent Neural Networks (RNNs), and</p></li>
|
||
<li><p>neural networks for unsupervised learning such as Deep Boltzmann Machines.</p></li>
|
||
</ol>
|
||
<p>In natural science, DNNs and CNNs have already found numerous
|
||
applications. In statistical physics, they have been applied to detect
|
||
phase transitions in 2D Ising and Potts models, lattice gauge
|
||
theories, and different phases of polymers, or solving the
|
||
Navier-Stokes equation in weather forecasting. Deep learning has also
|
||
found interesting applications in quantum physics. Various quantum
|
||
phase transitions can be detected and studied using DNNs and CNNs,
|
||
topological phases, and even non-equilibrium many-body
|
||
localization. Representing quantum states as DNNs quantum state
|
||
tomography are among some of the impressive achievements to reveal the
|
||
potential of DNNs to facilitate the study of quantum systems.</p>
|
||
<p>In quantum information theory, it has been shown that one can perform
|
||
gate decompositions with the help of neural.</p>
|
||
<p>The applications are not limited to the natural sciences. There is a
|
||
plethora of applications in essentially all disciplines, from the
|
||
humanities to life science and medicine.</p>
|
||
<p>An artificial neural network (ANN), is a computational model that
|
||
consists of layers of connected neurons, or nodes or units. We will
|
||
refer to these interchangeably as units or nodes, and sometimes as
|
||
neurons.</p>
|
||
<p>It is supposed to mimic a biological nervous system by letting each
|
||
neuron interact with other neurons by sending signals in the form of
|
||
mathematical functions between layers. A wide variety of different
|
||
ANNs have been developed, but most of them consist of an input layer,
|
||
an output layer and eventual layers in-between, called <em>hidden
|
||
layers</em>. All layers can contain an arbitrary number of nodes, and each
|
||
connection between two nodes is associated with a weight variable.</p>
|
||
<p>Neural networks (also called neural nets) are neural-inspired
|
||
nonlinear models for supervised learning. As we will see, neural nets
|
||
can be viewed as natural, more powerful extensions of supervised
|
||
learning methods such as linear and logistic regression and soft-max
|
||
methods we discussed earlier.</p>
|
||
<div class="section" id="feed-forward-neural-networks">
|
||
<h2><span class="section-number">13.1. </span>Feed-forward neural networks<a class="headerlink" href="#feed-forward-neural-networks" title="Permalink to this headline">¶</a></h2>
|
||
<p>The feed-forward neural network (FFNN) was the first and simplest type
|
||
of ANNs that were devised. In this network, the information moves in
|
||
only one direction: forward through the layers.</p>
|
||
<p>Nodes are represented by circles, while the arrows display the
|
||
connections between the nodes, including the direction of information
|
||
flow. Additionally, each arrow corresponds to a weight variable
|
||
(figure to come). We observe that each node in a layer is connected
|
||
to <em>all</em> nodes in the subsequent layer, making this a so-called
|
||
<em>fully-connected</em> FFNN.</p>
|
||
</div>
|
||
<div class="section" id="convolutional-neural-network">
|
||
<h2><span class="section-number">13.2. </span>Convolutional Neural Network<a class="headerlink" href="#convolutional-neural-network" title="Permalink to this headline">¶</a></h2>
|
||
<p>A different variant of FFNNs are <em>convolutional neural networks</em>
|
||
(CNNs), which have a connectivity pattern inspired by the animal
|
||
visual cortex. Individual neurons in the visual cortex only respond to
|
||
stimuli from small sub-regions of the visual field, called a receptive
|
||
field. This makes the neurons well-suited to exploit the strong
|
||
spatially local correlation present in natural images. The response of
|
||
each neuron can be approximated mathematically as a convolution
|
||
operation. (figure to come)</p>
|
||
<p>Convolutional neural networks emulate the behaviour of neurons in the
|
||
visual cortex by enforcing a <em>local</em> connectivity pattern between
|
||
nodes of adjacent layers: Each node in a convolutional layer is
|
||
connected only to a subset of the nodes in the previous layer, in
|
||
contrast to the fully-connected FFNN. Often, CNNs consist of several
|
||
convolutional layers that learn local features of the input, with a
|
||
fully-connected layer at the end, which gathers all the local data and
|
||
produces the outputs. They have wide applications in image and video
|
||
recognition.</p>
|
||
</div>
|
||
<div class="section" id="recurrent-neural-networks">
|
||
<h2><span class="section-number">13.3. </span>Recurrent neural networks<a class="headerlink" href="#recurrent-neural-networks" title="Permalink to this headline">¶</a></h2>
|
||
<p>So far we have only mentioned ANNs where information flows in one
|
||
direction: forward. <em>Recurrent neural networks</em> on the other hand,
|
||
have connections between nodes that form directed <em>cycles</em>. This
|
||
creates a form of internal memory which are able to capture
|
||
information on what has been calculated before; the output is
|
||
dependent on the previous computations. Recurrent NNs make use of
|
||
sequential information by performing the same task for every element
|
||
in a sequence, where each element depends on previous elements. An
|
||
example of such information is sentences, making recurrent NNs
|
||
especially well-suited for handwriting and speech recognition.</p>
|
||
</div>
|
||
<div class="section" id="other-types-of-networks">
|
||
<h2><span class="section-number">13.4. </span>Other types of networks<a class="headerlink" href="#other-types-of-networks" title="Permalink to this headline">¶</a></h2>
|
||
<p>There are many other kinds of ANNs that have been developed. One type
|
||
that is specifically designed for interpolation in multidimensional
|
||
space is the radial basis function (RBF) network. RBFs are typically
|
||
made up of three layers: an input layer, a hidden layer with
|
||
non-linear radial symmetric activation functions and a linear output
|
||
layer (‘’linear’’ here means that each node in the output layer has a
|
||
linear activation function). The layers are normally fully-connected
|
||
and there are no cycles, thus RBFs can be viewed as a type of
|
||
fully-connected FFNN. They are however usually treated as a separate
|
||
type of NN due the unusual activation functions.</p>
|
||
</div>
|
||
<div class="section" id="multilayer-perceptrons">
|
||
<h2><span class="section-number">13.5. </span>Multilayer perceptrons<a class="headerlink" href="#multilayer-perceptrons" title="Permalink to this headline">¶</a></h2>
|
||
<p>One uses often so-called fully-connected feed-forward neural networks
|
||
with three or more layers (an input layer, one or more hidden layers
|
||
and an output layer) consisting of neurons that have non-linear
|
||
activation functions.</p>
|
||
<p>Such networks are often called <em>multilayer perceptrons</em> (MLPs).</p>
|
||
<p>According to the <em>Universal approximation theorem</em>, a feed-forward
|
||
neural network with just a single hidden layer containing a finite
|
||
number of neurons can approximate a continuous multidimensional
|
||
function to arbitrary accuracy, assuming the activation function for
|
||
the hidden layer is a <strong>non-constant, bounded and
|
||
monotonically-increasing continuous function</strong>.</p>
|
||
<p>Note that the requirements on the activation function only applies to
|
||
the hidden layer, the output nodes are always assumed to be linear, so
|
||
as to not restrict the range of output values.</p>
|
||
<p>The output <span class="math notranslate nohighlight">\(y\)</span> is produced via the activation function <span class="math notranslate nohighlight">\(f\)</span></p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
y = f\left(\sum_{i=1}^n w_ix_i + b_i\right) = f(z),
|
||
\]</div>
|
||
<p>This function receives <span class="math notranslate nohighlight">\(x_i\)</span> as inputs.
|
||
Here the activation <span class="math notranslate nohighlight">\(z=(\sum_{i=1}^n w_ix_i+b_i)\)</span>.
|
||
In an FFNN of such neurons, the <em>inputs</em> <span class="math notranslate nohighlight">\(x_i\)</span> are the <em>outputs</em> of
|
||
the neurons in the preceding layer. Furthermore, an MLP is
|
||
fully-connected, which means that each neuron receives a weighted sum
|
||
of the outputs of <em>all</em> neurons in the previous layer.</p>
|
||
<p>First, for each node <span class="math notranslate nohighlight">\(i\)</span> in the first hidden layer, we calculate a weighted sum <span class="math notranslate nohighlight">\(z_i^1\)</span> of the input coordinates <span class="math notranslate nohighlight">\(x_j\)</span>,</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto1"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation} z_i^1 = \sum_{j=1}^{M} w_{ij}^1 x_j + b_i^1
|
||
\label{_auto1} \tag{2}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>Here <span class="math notranslate nohighlight">\(b_i\)</span> is the so-called bias which is normally needed in
|
||
case of zero activation weights or inputs. How to fix the biases and
|
||
the weights will be discussed below. The value of <span class="math notranslate nohighlight">\(z_i^1\)</span> is the
|
||
argument to the activation function <span class="math notranslate nohighlight">\(f_i\)</span> of each node <span class="math notranslate nohighlight">\(i\)</span>, The
|
||
variable <span class="math notranslate nohighlight">\(M\)</span> stands for all possible inputs to a given node <span class="math notranslate nohighlight">\(i\)</span> in the
|
||
first layer. We define the output <span class="math notranslate nohighlight">\(y_i^1\)</span> of all neurons in layer 1 as</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="outputLayer1"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
y_i^1 = f(z_i^1) = f\left(\sum_{j=1}^M w_{ij}^1 x_j + b_i^1\right)
|
||
\label{outputLayer1} \tag{3}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>where we assume that all nodes in the same layer have identical
|
||
activation functions, hence the notation <span class="math notranslate nohighlight">\(f\)</span>. In general, we could assume in the more general case that different layers have different activation functions.
|
||
In this case we would identify these functions with a superscript <span class="math notranslate nohighlight">\(l\)</span> for the <span class="math notranslate nohighlight">\(l\)</span>-th layer,</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="generalLayer"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
y_i^l = f^l(u_i^l) = f^l\left(\sum_{j=1}^{N_{l-1}} w_{ij}^l y_j^{l-1} + b_i^l\right)
|
||
\label{generalLayer} \tag{4}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>where <span class="math notranslate nohighlight">\(N_l\)</span> is the number of nodes in layer <span class="math notranslate nohighlight">\(l\)</span>. When the output of
|
||
all the nodes in the first hidden layer are computed, the values of
|
||
the subsequent layer can be calculated and so forth until the output
|
||
is obtained.</p>
|
||
<p>The output of neuron <span class="math notranslate nohighlight">\(i\)</span> in layer 2 is thus,</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto2"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
y_i^2 = f^2\left(\sum_{j=1}^N w_{ij}^2 y_j^1 + b_i^2\right)
|
||
\label{_auto2} \tag{5}
|
||
\end{equation}
|
||
\]</div>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="outputLayer2"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
= f^2\left[\sum_{j=1}^N w_{ij}^2f^1\left(\sum_{k=1}^M w_{jk}^1 x_k + b_j^1\right) + b_i^2\right]
|
||
\label{outputLayer2} \tag{6}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>where we have substituted <span class="math notranslate nohighlight">\(y_k^1\)</span> with the inputs <span class="math notranslate nohighlight">\(x_k\)</span>. Finally, the ANN output reads</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto3"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
y_i^3 = f^3\left(\sum_{j=1}^N w_{ij}^3 y_j^2 + b_i^3\right)
|
||
\label{_auto3} \tag{7}
|
||
\end{equation}
|
||
\]</div>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto4"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
= f_3\left[\sum_{j} w_{ij}^3 f^2\left(\sum_{k} w_{jk}^2 f^1\left(\sum_{m} w_{km}^1 x_m + b_k^1\right) + b_j^2\right)
|
||
+ b_1^3\right]
|
||
\label{_auto4} \tag{8}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>We can generalize this expression to an MLP with <span class="math notranslate nohighlight">\(l\)</span> hidden
|
||
layers. The complete functional form is,</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="completeNN"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
y^{l+1}_i = f^{l+1}\left[\!\sum_{j=1}^{N_l} w_{ij}^3 f^l\left(\sum_{k=1}^{N_{l-1}}w_{jk}^{l-1}\left(\dots f^1\left(\sum_{n=1}^{N_0} w_{mn}^1 x_n+ b_m^1\right)\dots\right)+b_k^2\right)+b_1^3\right]
|
||
\label{completeNN} \tag{9}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>which illustrates a basic property of MLPs: The only independent
|
||
variables are the input values <span class="math notranslate nohighlight">\(x_n\)</span>.</p>
|
||
<p>This confirms that an MLP, despite its quite convoluted mathematical
|
||
form, is nothing more than an analytic function, specifically a
|
||
mapping of real-valued vectors <span class="math notranslate nohighlight">\(\hat{x} \in \mathbb{R}^n \rightarrow
|
||
\hat{y} \in \mathbb{R}^m\)</span>.</p>
|
||
<p>Furthermore, the flexibility and universality of an MLP can be
|
||
illustrated by realizing that the expression is essentially a nested
|
||
sum of scaled activation functions of the form</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto5"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
f(x) = c_1 f(c_2 x + c_3) + c_4
|
||
\label{_auto5} \tag{10}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>where the parameters <span class="math notranslate nohighlight">\(c_i\)</span> are weights and biases. By adjusting these
|
||
parameters, the activation functions can be shifted up and down or
|
||
left and right, change slope or be rescaled which is the key to the
|
||
flexibility of a neural network.</p>
|
||
<p>We can introduce a more convenient notation for the activations in an A NN.</p>
|
||
<p>Additionally, we can represent the biases and activations
|
||
as layer-wise column vectors <span class="math notranslate nohighlight">\(\hat{b}_l\)</span> and <span class="math notranslate nohighlight">\(\hat{y}_l\)</span>, so that the <span class="math notranslate nohighlight">\(i\)</span>-th element of each vector
|
||
is the bias <span class="math notranslate nohighlight">\(b_i^l\)</span> and activation <span class="math notranslate nohighlight">\(y_i^l\)</span> of node <span class="math notranslate nohighlight">\(i\)</span> in layer <span class="math notranslate nohighlight">\(l\)</span> respectively.</p>
|
||
<p>We have that <span class="math notranslate nohighlight">\(\mathrm{W}_l\)</span> is an <span class="math notranslate nohighlight">\(N_{l-1} \times N_l\)</span> matrix, while <span class="math notranslate nohighlight">\(\hat{b}_l\)</span> and <span class="math notranslate nohighlight">\(\hat{y}_l\)</span> are <span class="math notranslate nohighlight">\(N_l \times 1\)</span> column vectors.
|
||
With this notation, the sum becomes a matrix-vector multiplication, and we can write
|
||
the equation for the activations of hidden layer 2 (assuming three nodes for simplicity) as</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto6"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[\begin{split}
|
||
\begin{equation}
|
||
\hat{y}_2 = f_2(\mathrm{W}_2 \hat{y}_{1} + \hat{b}_{2}) =
|
||
f_2\left(\left[\begin{array}{ccc}
|
||
w^2_{11} &w^2_{12} &w^2_{13} \\
|
||
w^2_{21} &w^2_{22} &w^2_{23} \\
|
||
w^2_{31} &w^2_{32} &w^2_{33} \\
|
||
\end{array} \right] \cdot
|
||
\left[\begin{array}{c}
|
||
y^1_1 \\
|
||
y^1_2 \\
|
||
y^1_3 \\
|
||
\end{array}\right] +
|
||
\left[\begin{array}{c}
|
||
b^2_1 \\
|
||
b^2_2 \\
|
||
b^2_3 \\
|
||
\end{array}\right]\right).
|
||
\label{_auto6} \tag{11}
|
||
\end{equation}
|
||
\end{split}\]</div>
|
||
<div class="section" id="matrix-vector-notation-and-activation">
|
||
<h3><span class="section-number">13.5.1. </span>Matrix-vector notation and activation<a class="headerlink" href="#matrix-vector-notation-and-activation" title="Permalink to this headline">¶</a></h3>
|
||
<p>The activation of node <span class="math notranslate nohighlight">\(i\)</span> in layer 2 is</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto7"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
y^2_i = f_2\Bigr(w^2_{i1}y^1_1 + w^2_{i2}y^1_2 + w^2_{i3}y^1_3 + b^2_i\Bigr) =
|
||
f_2\left(\sum_{j=1}^3 w^2_{ij} y_j^1 + b^2_i\right).
|
||
\label{_auto7} \tag{12}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>This is not just a convenient and compact notation, but also a useful
|
||
and intuitive way to think about MLPs: The output is calculated by a
|
||
series of matrix-vector multiplications and vector additions that are
|
||
used as input to the activation functions. For each operation
|
||
<span class="math notranslate nohighlight">\(\mathrm{W}_l \hat{y}_{l-1}\)</span> we move forward one layer.</p>
|
||
</div>
|
||
<div class="section" id="activation-functions">
|
||
<h3><span class="section-number">13.5.2. </span>Activation functions<a class="headerlink" href="#activation-functions" title="Permalink to this headline">¶</a></h3>
|
||
<p>A property that characterizes a neural network, other than its
|
||
connectivity, is the choice of activation function(s). As described
|
||
in, the following restrictions are imposed on an activation function
|
||
for a FFNN to fulfill the universal approximation theorem</p>
|
||
<ul class="simple">
|
||
<li><p>Non-constant</p></li>
|
||
<li><p>Bounded</p></li>
|
||
<li><p>Monotonically-increasing</p></li>
|
||
<li><p>Continuous</p></li>
|
||
</ul>
|
||
<p>The second requirement excludes all linear functions. Furthermore, in
|
||
a MLP with only linear activation functions, each layer simply
|
||
performs a linear transformation of its inputs.</p>
|
||
<p>Regardless of the number of layers, the output of the NN will be
|
||
nothing but a linear function of the inputs. Thus we need to introduce
|
||
some kind of non-linearity to the NN to be able to fit non-linear
|
||
functions Typical examples are the logistic <em>Sigmoid</em></p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
f(x) = \frac{1}{1 + e^{-x}},
|
||
\]</div>
|
||
<p>and the <em>hyperbolic tangent</em> function</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
f(x) = \tanh(x)
|
||
\]</div>
|
||
<p>The <em>sigmoid</em> function are more biologically plausible because the
|
||
output of inactive neurons are zero. Such activation function are
|
||
called <em>one-sided</em>. However, it has been shown that the hyperbolic
|
||
tangent performs better than the sigmoid for training MLPs. has
|
||
become the most popular for <em>deep neural networks</em></p>
|
||
<div class="cell docutils container">
|
||
<div class="cell_input docutils container">
|
||
<div class="highlight-ipython3 notranslate"><div class="highlight"><pre><span></span><span class="o">%</span><span class="k">matplotlib</span> inline
|
||
|
||
<span class="sd">"""The sigmoid function (or the logistic curve) is a </span>
|
||
<span class="sd">function that takes any real number, z, and outputs a number (0,1).</span>
|
||
<span class="sd">It is useful in neural networks for assigning weights on a relative scale.</span>
|
||
<span class="sd">The value z is the weighted sum of parameters involved in the learning algorithm."""</span>
|
||
|
||
<span class="kn">import</span> <span class="nn">numpy</span>
|
||
<span class="kn">import</span> <span class="nn">matplotlib.pyplot</span> <span class="k">as</span> <span class="nn">plt</span>
|
||
<span class="kn">import</span> <span class="nn">math</span> <span class="k">as</span> <span class="nn">mt</span>
|
||
|
||
<span class="n">z</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">arange</span><span class="p">(</span><span class="o">-</span><span class="mi">5</span><span class="p">,</span> <span class="mi">5</span><span class="p">,</span> <span class="mf">.1</span><span class="p">)</span>
|
||
<span class="n">sigma_fn</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">vectorize</span><span class="p">(</span><span class="k">lambda</span> <span class="n">z</span><span class="p">:</span> <span class="mi">1</span><span class="o">/</span><span class="p">(</span><span class="mi">1</span><span class="o">+</span><span class="n">numpy</span><span class="o">.</span><span class="n">exp</span><span class="p">(</span><span class="o">-</span><span class="n">z</span><span class="p">)))</span>
|
||
<span class="n">sigma</span> <span class="o">=</span> <span class="n">sigma_fn</span><span class="p">(</span><span class="n">z</span><span class="p">)</span>
|
||
|
||
<span class="n">fig</span> <span class="o">=</span> <span class="n">plt</span><span class="o">.</span><span class="n">figure</span><span class="p">()</span>
|
||
<span class="n">ax</span> <span class="o">=</span> <span class="n">fig</span><span class="o">.</span><span class="n">add_subplot</span><span class="p">(</span><span class="mi">111</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">plot</span><span class="p">(</span><span class="n">z</span><span class="p">,</span> <span class="n">sigma</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_ylim</span><span class="p">([</span><span class="o">-</span><span class="mf">0.1</span><span class="p">,</span> <span class="mf">1.1</span><span class="p">])</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_xlim</span><span class="p">([</span><span class="o">-</span><span class="mi">5</span><span class="p">,</span><span class="mi">5</span><span class="p">])</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">grid</span><span class="p">(</span><span class="kc">True</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_xlabel</span><span class="p">(</span><span class="s1">'z'</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_title</span><span class="p">(</span><span class="s1">'sigmoid function'</span><span class="p">)</span>
|
||
|
||
<span class="n">plt</span><span class="o">.</span><span class="n">show</span><span class="p">()</span>
|
||
|
||
<span class="sd">"""Step Function"""</span>
|
||
<span class="n">z</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">arange</span><span class="p">(</span><span class="o">-</span><span class="mi">5</span><span class="p">,</span> <span class="mi">5</span><span class="p">,</span> <span class="mf">.02</span><span class="p">)</span>
|
||
<span class="n">step_fn</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">vectorize</span><span class="p">(</span><span class="k">lambda</span> <span class="n">z</span><span class="p">:</span> <span class="mf">1.0</span> <span class="k">if</span> <span class="n">z</span> <span class="o">>=</span> <span class="mf">0.0</span> <span class="k">else</span> <span class="mf">0.0</span><span class="p">)</span>
|
||
<span class="n">step</span> <span class="o">=</span> <span class="n">step_fn</span><span class="p">(</span><span class="n">z</span><span class="p">)</span>
|
||
|
||
<span class="n">fig</span> <span class="o">=</span> <span class="n">plt</span><span class="o">.</span><span class="n">figure</span><span class="p">()</span>
|
||
<span class="n">ax</span> <span class="o">=</span> <span class="n">fig</span><span class="o">.</span><span class="n">add_subplot</span><span class="p">(</span><span class="mi">111</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">plot</span><span class="p">(</span><span class="n">z</span><span class="p">,</span> <span class="n">step</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_ylim</span><span class="p">([</span><span class="o">-</span><span class="mf">0.5</span><span class="p">,</span> <span class="mf">1.5</span><span class="p">])</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_xlim</span><span class="p">([</span><span class="o">-</span><span class="mi">5</span><span class="p">,</span><span class="mi">5</span><span class="p">])</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">grid</span><span class="p">(</span><span class="kc">True</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_xlabel</span><span class="p">(</span><span class="s1">'z'</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_title</span><span class="p">(</span><span class="s1">'step function'</span><span class="p">)</span>
|
||
|
||
<span class="n">plt</span><span class="o">.</span><span class="n">show</span><span class="p">()</span>
|
||
|
||
<span class="sd">"""Sine Function"""</span>
|
||
<span class="n">z</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">arange</span><span class="p">(</span><span class="o">-</span><span class="mi">2</span><span class="o">*</span><span class="n">mt</span><span class="o">.</span><span class="n">pi</span><span class="p">,</span> <span class="mi">2</span><span class="o">*</span><span class="n">mt</span><span class="o">.</span><span class="n">pi</span><span class="p">,</span> <span class="mf">0.1</span><span class="p">)</span>
|
||
<span class="n">t</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">sin</span><span class="p">(</span><span class="n">z</span><span class="p">)</span>
|
||
|
||
<span class="n">fig</span> <span class="o">=</span> <span class="n">plt</span><span class="o">.</span><span class="n">figure</span><span class="p">()</span>
|
||
<span class="n">ax</span> <span class="o">=</span> <span class="n">fig</span><span class="o">.</span><span class="n">add_subplot</span><span class="p">(</span><span class="mi">111</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">plot</span><span class="p">(</span><span class="n">z</span><span class="p">,</span> <span class="n">t</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_ylim</span><span class="p">([</span><span class="o">-</span><span class="mf">1.0</span><span class="p">,</span> <span class="mf">1.0</span><span class="p">])</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_xlim</span><span class="p">([</span><span class="o">-</span><span class="mi">2</span><span class="o">*</span><span class="n">mt</span><span class="o">.</span><span class="n">pi</span><span class="p">,</span><span class="mi">2</span><span class="o">*</span><span class="n">mt</span><span class="o">.</span><span class="n">pi</span><span class="p">])</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">grid</span><span class="p">(</span><span class="kc">True</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_xlabel</span><span class="p">(</span><span class="s1">'z'</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_title</span><span class="p">(</span><span class="s1">'sine function'</span><span class="p">)</span>
|
||
|
||
<span class="n">plt</span><span class="o">.</span><span class="n">show</span><span class="p">()</span>
|
||
|
||
<span class="sd">"""Plots a graph of the squashing function used by a rectified linear</span>
|
||
<span class="sd">unit"""</span>
|
||
<span class="n">z</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">arange</span><span class="p">(</span><span class="o">-</span><span class="mi">2</span><span class="p">,</span> <span class="mi">2</span><span class="p">,</span> <span class="mf">.1</span><span class="p">)</span>
|
||
<span class="n">zero</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">zeros</span><span class="p">(</span><span class="nb">len</span><span class="p">(</span><span class="n">z</span><span class="p">))</span>
|
||
<span class="n">y</span> <span class="o">=</span> <span class="n">numpy</span><span class="o">.</span><span class="n">max</span><span class="p">([</span><span class="n">zero</span><span class="p">,</span> <span class="n">z</span><span class="p">],</span> <span class="n">axis</span><span class="o">=</span><span class="mi">0</span><span class="p">)</span>
|
||
|
||
<span class="n">fig</span> <span class="o">=</span> <span class="n">plt</span><span class="o">.</span><span class="n">figure</span><span class="p">()</span>
|
||
<span class="n">ax</span> <span class="o">=</span> <span class="n">fig</span><span class="o">.</span><span class="n">add_subplot</span><span class="p">(</span><span class="mi">111</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">plot</span><span class="p">(</span><span class="n">z</span><span class="p">,</span> <span class="n">y</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_ylim</span><span class="p">([</span><span class="o">-</span><span class="mf">2.0</span><span class="p">,</span> <span class="mf">2.0</span><span class="p">])</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_xlim</span><span class="p">([</span><span class="o">-</span><span class="mf">2.0</span><span class="p">,</span> <span class="mf">2.0</span><span class="p">])</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">grid</span><span class="p">(</span><span class="kc">True</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_xlabel</span><span class="p">(</span><span class="s1">'z'</span><span class="p">)</span>
|
||
<span class="n">ax</span><span class="o">.</span><span class="n">set_title</span><span class="p">(</span><span class="s1">'Rectified linear unit'</span><span class="p">)</span>
|
||
|
||
<span class="n">plt</span><span class="o">.</span><span class="n">show</span><span class="p">()</span>
|
||
</pre></div>
|
||
</div>
|
||
</div>
|
||
<div class="cell_output docutils container">
|
||
<img alt="_images/chapter9_29_0.png" src="_images/chapter9_29_0.png" />
|
||
<img alt="_images/chapter9_29_1.png" src="_images/chapter9_29_1.png" />
|
||
<img alt="_images/chapter9_29_2.png" src="_images/chapter9_29_2.png" />
|
||
<img alt="_images/chapter9_29_3.png" src="_images/chapter9_29_3.png" />
|
||
</div>
|
||
</div>
|
||
</div>
|
||
</div>
|
||
<div class="section" id="the-multilayer-perceptron-mlp">
|
||
<h2><span class="section-number">13.6. </span>The multilayer perceptron (MLP)<a class="headerlink" href="#the-multilayer-perceptron-mlp" title="Permalink to this headline">¶</a></h2>
|
||
<p>The multilayer perceptron is a very popular, and easy to implement approach, to deep learning. It consists of</p>
|
||
<ol class="simple">
|
||
<li><p>A neural network with one or more layers of nodes between the input and the output nodes.</p></li>
|
||
<li><p>The multilayer network structure, or architecture, or topology, consists of an input layer, one or more hidden layers, and one output layer.</p></li>
|
||
<li><p>The input nodes pass values to the first hidden layer, its nodes pass the information on to the second and so on till we reach the output layer.</p></li>
|
||
</ol>
|
||
<p>As a convention it is normal to call a network with one layer of input units, one layer of hidden
|
||
units and one layer of output units as a two-layer network. A network with two layers of hidden units is called a three-layer network etc etc.</p>
|
||
<p>For an MLP network there is no direct connection between the output nodes/neurons/units and the input nodes/neurons/units.
|
||
Hereafter we will call the various entities of a layer for nodes.
|
||
There are also no connections within a single layer.</p>
|
||
<p>The number of input nodes does not need to equal the number of output
|
||
nodes. This applies also to the hidden layers. Each layer may have its
|
||
own number of nodes and activation functions.</p>
|
||
<p>The hidden layers have their name from the fact that they are not
|
||
linked to observables and as we will see below when we define the
|
||
so-called activation <span class="math notranslate nohighlight">\(\hat{z}\)</span>, we can think of this as a basis
|
||
expansion of the original inputs <span class="math notranslate nohighlight">\(\hat{x}\)</span>. The difference however
|
||
between neural networks and say linear regression is that now these
|
||
basis functions (which will correspond to the weights in the network)
|
||
are learned from data. This results in an important difference between
|
||
neural networks and deep learning approaches on one side and methods
|
||
like logistic regression or linear regression and their modifications on the other side.</p>
|
||
<div class="section" id="from-one-to-many-layers-the-universal-approximation-theorem">
|
||
<h3><span class="section-number">13.6.1. </span>From one to many layers, the universal approximation theorem<a class="headerlink" href="#from-one-to-many-layers-the-universal-approximation-theorem" title="Permalink to this headline">¶</a></h3>
|
||
<p>A neural network with only one layer, what we called the simple
|
||
perceptron, is best suited if we have a standard binary model with
|
||
clear (linear) boundaries between the outcomes. As such it could
|
||
equally well be replaced by standard linear regression or logistic
|
||
regression. Networks with one or more hidden layers approximate
|
||
systems with more complex boundaries.</p>
|
||
<p>As stated earlier,
|
||
an important theorem in studies of neural networks, restated without
|
||
proof here, is the <a class="reference external" href="http://citeseerx.ist.psu.edu/viewdoc/download?doi=10.1.1.441.7873&rep=rep1&type=pdf">universal approximation
|
||
theorem</a>.</p>
|
||
<p>It states that a feed-forward network with a single hidden layer
|
||
containing a finite number of neurons can approximate continuous
|
||
functions on compact subsets of real functions. The theorem thus
|
||
states that simple neural networks can represent a wide variety of
|
||
interesting functions when given appropriate parameters. It is the
|
||
multilayer feedforward architecture itself which gives neural networks
|
||
the potential of being universal approximators.</p>
|
||
</div>
|
||
</div>
|
||
<div class="section" id="deriving-the-back-propagation-code-for-a-multilayer-perceptron-model">
|
||
<h2><span class="section-number">13.7. </span>Deriving the back propagation code for a multilayer perceptron model<a class="headerlink" href="#deriving-the-back-propagation-code-for-a-multilayer-perceptron-model" title="Permalink to this headline">¶</a></h2>
|
||
<p>As we have seen now in a feed forward network, we can express the final output of our network in terms of basic matrix-vector multiplications.
|
||
The unknowwn quantities are our weights <span class="math notranslate nohighlight">\(w_{ij}\)</span> and we need to find an algorithm for changing them so that our errors are as small as possible.
|
||
This leads us to the famous <a class="reference external" href="https://www.nature.com/articles/323533a0">back propagation algorithm</a>.</p>
|
||
<p>The questions we want to ask are how do changes in the biases and the
|
||
weights in our network change the cost function and how can we use the
|
||
final output to modify the weights?</p>
|
||
<p>To derive these equations let us start with a plain regression problem
|
||
and define our cost function as</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
{\cal C}(\hat{W}) = \frac{1}{2}\sum_{i=1}^n\left(y_i - t_i\right)^2,
|
||
\]</div>
|
||
<p>where the <span class="math notranslate nohighlight">\(t_i\)</span>s are our <span class="math notranslate nohighlight">\(n\)</span> targets (the values we want to
|
||
reproduce), while the outputs of the network after having propagated
|
||
all inputs <span class="math notranslate nohighlight">\(\hat{x}\)</span> are given by <span class="math notranslate nohighlight">\(y_i\)</span>. Below we will demonstrate
|
||
how the basic equations arising from the back propagation algorithm
|
||
can be modified in order to study classification problems with <span class="math notranslate nohighlight">\(K\)</span>
|
||
classes.</p>
|
||
<p>With our definition of the targets <span class="math notranslate nohighlight">\(\hat{t}\)</span>, the outputs of the
|
||
network <span class="math notranslate nohighlight">\(\hat{y}\)</span> and the inputs <span class="math notranslate nohighlight">\(\hat{x}\)</span> we
|
||
define now the activation <span class="math notranslate nohighlight">\(z_j^l\)</span> of node/neuron/unit <span class="math notranslate nohighlight">\(j\)</span> of the
|
||
<span class="math notranslate nohighlight">\(l\)</span>-th layer as a function of the bias, the weights which add up from
|
||
the previous layer <span class="math notranslate nohighlight">\(l-1\)</span> and the forward passes/outputs
|
||
<span class="math notranslate nohighlight">\(\hat{a}^{l-1}\)</span> from the previous layer as</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
z_j^l = \sum_{i=1}^{M_{l-1}}w_{ij}^la_i^{l-1}+b_j^l,
|
||
\]</div>
|
||
<p>where <span class="math notranslate nohighlight">\(b_k^l\)</span> are the biases from layer <span class="math notranslate nohighlight">\(l\)</span>. Here <span class="math notranslate nohighlight">\(M_{l-1}\)</span>
|
||
represents the total number of nodes/neurons/units of layer <span class="math notranslate nohighlight">\(l-1\)</span>. The
|
||
figure here illustrates this equation. We can rewrite this in a more
|
||
compact form as the matrix-vector products we discussed earlier,</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\hat{z}^l = \left(\hat{W}^l\right)^T\hat{a}^{l-1}+\hat{b}^l.
|
||
\]</div>
|
||
<p>With the activation values <span class="math notranslate nohighlight">\(\hat{z}^l\)</span> we can in turn define the
|
||
output of layer <span class="math notranslate nohighlight">\(l\)</span> as <span class="math notranslate nohighlight">\(\hat{a}^l = f(\hat{z}^l)\)</span> where <span class="math notranslate nohighlight">\(f\)</span> is our
|
||
activation function. In the examples here we will use the sigmoid
|
||
function discussed in our logistic regression lectures. We will also use the same activation function <span class="math notranslate nohighlight">\(f\)</span> for all layers
|
||
and their nodes. It means we have</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
a_j^l = f(z_j^l) = \frac{1}{1+\exp{-(z_j^l)}}.
|
||
\]</div>
|
||
<div class="section" id="derivatives-and-the-chain-rule">
|
||
<h3><span class="section-number">13.7.1. </span>Derivatives and the chain rule<a class="headerlink" href="#derivatives-and-the-chain-rule" title="Permalink to this headline">¶</a></h3>
|
||
<p>From the definition of the activation <span class="math notranslate nohighlight">\(z_j^l\)</span> we have</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\frac{\partial z_j^l}{\partial w_{ij}^l} = a_i^{l-1},
|
||
\]</div>
|
||
<p>and</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\frac{\partial z_j^l}{\partial a_i^{l-1}} = w_{ji}^l.
|
||
\]</div>
|
||
<p>With our definition of the activation function we have that (note that this function depends only on <span class="math notranslate nohighlight">\(z_j^l\)</span>)</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\frac{\partial a_j^l}{\partial z_j^{l}} = a_j^l(1-a_j^l)=f(z_j^l)(1-f(z_j^l)).
|
||
\]</div>
|
||
<p>With these definitions we can now compute the derivative of the cost function in terms of the weights.</p>
|
||
<p>Let us specialize to the output layer <span class="math notranslate nohighlight">\(l=L\)</span>. Our cost function is</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
{\cal C}(\hat{W^L}) = \frac{1}{2}\sum_{i=1}^n\left(y_i - t_i\right)^2=\frac{1}{2}\sum_{i=1}^n\left(a_i^L - t_i\right)^2,
|
||
\]</div>
|
||
<p>The derivative of this function with respect to the weights is</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\frac{\partial{\cal C}(\hat{W^L})}{\partial w_{jk}^L} = \left(a_j^L - t_j\right)\frac{\partial a_j^L}{\partial w_{jk}^{L}},
|
||
\]</div>
|
||
<p>The last partial derivative can easily be computed and reads (by applying the chain rule)</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\frac{\partial a_j^L}{\partial w_{jk}^{L}} = \frac{\partial a_j^L}{\partial z_{j}^{L}}\frac{\partial z_j^L}{\partial w_{jk}^{L}}=a_j^L(1-a_j^L)a_k^{L-1},
|
||
\]</div>
|
||
</div>
|
||
<div class="section" id="bringing-it-together-first-back-propagation-equation">
|
||
<h3><span class="section-number">13.7.2. </span>Bringing it together, first back propagation equation<a class="headerlink" href="#bringing-it-together-first-back-propagation-equation" title="Permalink to this headline">¶</a></h3>
|
||
<p>We have thus</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\frac{\partial{\cal C}(\hat{W^L})}{\partial w_{jk}^L} = \left(a_j^L - t_j\right)a_j^L(1-a_j^L)a_k^{L-1},
|
||
\]</div>
|
||
<p>Defining</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\delta_j^L = a_j^L(1-a_j^L)\left(a_j^L - t_j\right) = f'(z_j^L)\frac{\partial {\cal C}}{\partial (a_j^L)},
|
||
\]</div>
|
||
<p>and using the Hadamard product of two vectors we can write this as</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\hat{\delta}^L = f'(\hat{z}^L)\circ\frac{\partial {\cal C}}{\partial (\hat{a}^L)}.
|
||
\]</div>
|
||
<p>This is an important expression. The second term on the right handside
|
||
measures how fast the cost function is changing as a function of the <span class="math notranslate nohighlight">\(j\)</span>th
|
||
output activation. If, for example, the cost function doesn’t depend
|
||
much on a particular output node <span class="math notranslate nohighlight">\(j\)</span>, then <span class="math notranslate nohighlight">\(\delta_j^L\)</span> will be small,
|
||
which is what we would expect. The first term on the right, measures
|
||
how fast the activation function <span class="math notranslate nohighlight">\(f\)</span> is changing at a given activation
|
||
value <span class="math notranslate nohighlight">\(z_j^L\)</span>.</p>
|
||
<p>Notice that everything in the above equations is easily computed. In
|
||
particular, we compute <span class="math notranslate nohighlight">\(z_j^L\)</span> while computing the behaviour of the
|
||
network, and it is only a small additional overhead to compute
|
||
<span class="math notranslate nohighlight">\(f'(z^L_j)\)</span>. The exact form of the derivative with respect to the
|
||
output depends on the form of the cost function.
|
||
However, provided the cost function is known there should be little
|
||
trouble in calculating</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\frac{\partial {\cal C}}{\partial (a_j^L)}
|
||
\]</div>
|
||
<p>With the definition of <span class="math notranslate nohighlight">\(\delta_j^L\)</span> we have a more compact definition of the derivative of the cost function in terms of the weights, namely</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\frac{\partial{\cal C}(\hat{W^L})}{\partial w_{jk}^L} = \delta_j^La_k^{L-1}.
|
||
\]</div>
|
||
<p>It is also easy to see that our previous equation can be written as</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\delta_j^L =\frac{\partial {\cal C}}{\partial z_j^L}= \frac{\partial {\cal C}}{\partial a_j^L}\frac{\partial a_j^L}{\partial z_j^L},
|
||
\]</div>
|
||
<p>which can also be interpreted as the partial derivative of the cost function with respect to the biases <span class="math notranslate nohighlight">\(b_j^L\)</span>, namely</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\delta_j^L = \frac{\partial {\cal C}}{\partial b_j^L}\frac{\partial b_j^L}{\partial z_j^L}=\frac{\partial {\cal C}}{\partial b_j^L},
|
||
\]</div>
|
||
<p>That is, the error <span class="math notranslate nohighlight">\(\delta_j^L\)</span> is exactly equal to the rate of change of the cost function as a function of the bias.</p>
|
||
<p>We have now three equations that are essential for the computations of the derivatives of the cost function at the output layer. These equations are needed to start the algorithm and they are</p>
|
||
<p><strong>The starting equations.</strong></p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto8"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
\frac{\partial{\cal C}(\hat{W^L})}{\partial w_{jk}^L} = \delta_j^La_k^{L-1},
|
||
\label{_auto8} \tag{13}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>and</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto9"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
\delta_j^L = f'(z_j^L)\frac{\partial {\cal C}}{\partial (a_j^L)},
|
||
\label{_auto9} \tag{14}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>and</p>
|
||
<!-- Equation labels as ordinary links -->
|
||
<div id="_auto10"></div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\begin{equation}
|
||
\delta_j^L = \frac{\partial {\cal C}}{\partial b_j^L},
|
||
\label{_auto10} \tag{15}
|
||
\end{equation}
|
||
\]</div>
|
||
<p>An interesting consequence of the above equations is that when the
|
||
activation <span class="math notranslate nohighlight">\(a_k^{L-1}\)</span> is small, the gradient term, that is the
|
||
derivative of the cost function with respect to the weights, will also
|
||
tend to be small. We say then that the weight learns slowly, meaning
|
||
that it changes slowly when we minimize the weights via say gradient
|
||
descent. In this case we say the system learns slowly.</p>
|
||
<p>Another interesting feature is that is when the activation function,
|
||
represented by the sigmoid function here, is rather flat when we move towards
|
||
its end values <span class="math notranslate nohighlight">\(0\)</span> and <span class="math notranslate nohighlight">\(1\)</span> (see the above Python codes). In these
|
||
cases, the derivatives of the activation function will also be close
|
||
to zero, meaning again that the gradients will be small and the
|
||
network learns slowly again.</p>
|
||
<p>We need a fourth equation and we are set. We are going to propagate
|
||
backwards in order to the determine the weights and biases. In order
|
||
to do so we need to represent the error in the layer before the final
|
||
one <span class="math notranslate nohighlight">\(L-1\)</span> in terms of the errors in the final output layer.</p>
|
||
</div>
|
||
<div class="section" id="final-back-propagating-equation">
|
||
<h3><span class="section-number">13.7.3. </span>Final back propagating equation<a class="headerlink" href="#final-back-propagating-equation" title="Permalink to this headline">¶</a></h3>
|
||
<p>We have that (replacing <span class="math notranslate nohighlight">\(L\)</span> with a general layer <span class="math notranslate nohighlight">\(l\)</span>)</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\delta_j^l =\frac{\partial {\cal C}}{\partial z_j^l}.
|
||
\]</div>
|
||
<p>We want to express this in terms of the equations for layer <span class="math notranslate nohighlight">\(l+1\)</span>. Using the chain rule and summing over all <span class="math notranslate nohighlight">\(k\)</span> entries we have</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\delta_j^l =\sum_k \frac{\partial {\cal C}}{\partial z_k^{l+1}}\frac{\partial z_k^{l+1}}{\partial z_j^{l}}=\sum_k \delta_k^{l+1}\frac{\partial z_k^{l+1}}{\partial z_j^{l}},
|
||
\]</div>
|
||
<p>and recalling that</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
z_j^{l+1} = \sum_{i=1}^{M_{l}}w_{ij}^{l+1}a_i^{l}+b_j^{l+1},
|
||
\]</div>
|
||
<p>with <span class="math notranslate nohighlight">\(M_l\)</span> being the number of nodes in layer <span class="math notranslate nohighlight">\(l\)</span>, we obtain</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\delta_j^l =\sum_k \delta_k^{l+1}w_{kj}^{l+1}f'(z_j^l),
|
||
\]</div>
|
||
<p>This is our final equation.</p>
|
||
<p>We are now ready to set up the algorithm for back propagation and learning the weights and biases.</p>
|
||
</div>
|
||
<div class="section" id="setting-up-the-back-propagation-algorithm">
|
||
<h3><span class="section-number">13.7.4. </span>Setting up the Back propagation algorithm<a class="headerlink" href="#setting-up-the-back-propagation-algorithm" title="Permalink to this headline">¶</a></h3>
|
||
<p>The four equations provide us with a way of computing the gradient of the cost function. Let us write this out in the form of an algorithm.</p>
|
||
<p>First, we set up the input data <span class="math notranslate nohighlight">\(\hat{x}\)</span> and the activations
|
||
<span class="math notranslate nohighlight">\(\hat{z}_1\)</span> of the input layer and compute the activation function and
|
||
the pertinent outputs <span class="math notranslate nohighlight">\(\hat{a}^1\)</span>.</p>
|
||
<p>Secondly, we perform then the feed forward till we reach the output
|
||
layer and compute all <span class="math notranslate nohighlight">\(\hat{z}_l\)</span> of the input layer and compute the
|
||
activation function and the pertinent outputs <span class="math notranslate nohighlight">\(\hat{a}^l\)</span> for
|
||
<span class="math notranslate nohighlight">\(l=2,3,\dots,L\)</span>.</p>
|
||
<p>Thereafter we compute the ouput error <span class="math notranslate nohighlight">\(\hat{\delta}^L\)</span> by computing all</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\delta_j^L = f'(z_j^L)\frac{\partial {\cal C}}{\partial (a_j^L)}.
|
||
\]</div>
|
||
<p>Then we compute the back propagate error for each <span class="math notranslate nohighlight">\(l=L-1,L-2,\dots,2\)</span> as</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
\delta_j^l = \sum_k \delta_k^{l+1}w_{kj}^{l+1}f'(z_j^l).
|
||
\]</div>
|
||
<p>Finally, we update the weights and the biases using gradient descent for each <span class="math notranslate nohighlight">\(l=L-1,L-2,\dots,2\)</span> and update the weights and biases according to the rules</p>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
w_{jk}^l\leftarrow = w_{jk}^l- \eta \delta_j^la_k^{l-1},
|
||
\]</div>
|
||
<div class="math notranslate nohighlight">
|
||
\[
|
||
b_j^l \leftarrow b_j^l-\eta \frac{\partial {\cal C}}{\partial b_j^l}=b_j^l-\eta \delta_j^l,
|
||
\]</div>
|
||
<p>The parameter <span class="math notranslate nohighlight">\(\eta\)</span> is the learning parameter discussed in connection with the gradient descent methods.
|
||
Here it is convenient to use stochastic gradient descent (see the examples below) with mini-batches with an outer loop that steps through multiple epochs of training.</p>
|
||
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