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Shape of 'non_edge_index' in 'mol_building_env' causes invalid_losses > 0 #137

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hohyun312 opened this issue Sep 5, 2024 · 0 comments

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@hohyun312
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non_edge_index = np.zeros((2, 0), dtype=np.int64)

While running test tasks on 'mol_building_env', I encountered 'invalid_losses'. After investigating, I discovered that the shape of non_edge_index was incorrect. This issue can be easily fixed by setting non_edge_index = np.zeros((0, 2), dtype=np.int64). The correct shape is needed for line 382, where non_edge_index.shape[0] is used.

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