Add post_pos as a model target via travel_dir decomposition
step_length already encodes |post_pos - pre_pos| by definition, so a raw post_pos target would duplicate that magnitude and could drift inconsistent with step_length during sampling. Instead add travel_dir, a unit vector (local frame) giving only the direction of pre_pos->post_pos; post_pos is reconstructed at inference as pre_pos + step_length * travel_dir, keeping the two self-consistent. Target grows from 6D to 9D. Co-Authored-By: Claude Sonnet 4.6 <noreply@anthropic.com>
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@@ -18,7 +18,7 @@ def test_sinusoidal_embedding_batch_1():
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def test_denoising_mlp_output_shape():
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B = 8
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model = DenoisingMLP(pdg_vocab=5, mat_vocab=3)
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x_t = torch.randn(B, 6)
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x_t = torch.randn(B, 9)
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t = torch.rand(B)
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cond_cont = torch.randn(B, 9)
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cond_cat = torch.stack([
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@@ -26,13 +26,13 @@ def test_denoising_mlp_output_shape():
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torch.randint(0, 3, (B,)),
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], dim=1)
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out = model(x_t, t, cond_cont, cond_cat)
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assert out.shape == (B, 6)
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assert out.shape == (B, 9)
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def test_denoising_mlp_gradients_flow():
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B = 4
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model = DenoisingMLP(pdg_vocab=3, mat_vocab=2, hidden_dim=32, n_blocks=2)
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x_t = torch.randn(B, 6)
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x_t = torch.randn(B, 9)
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t = torch.rand(B)
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cond_cont = torch.randn(B, 9)
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cond_cat = torch.zeros(B, 2, dtype=torch.long)
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