Updated predicting affinity notebook

kevinmicha · May 31, 2024 · 0892be6 · 0892be6
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diff --git a/...points/full_ags_all_modes/learnt_filter_epochs_1044_modes_all_pool_1_filters_4_size_4.npy b/...points/full_ags_all_modes/learnt_filter_epochs_1044_modes_all_pool_1_filters_4_size_4.npy
diff --git a/...points/full_ags_all_modes/learnt_filter_epochs_1490_modes_all_pool_0_filters_0_size_0.npy b/...points/full_ags_all_modes/learnt_filter_epochs_1490_modes_all_pool_0_filters_0_size_0.npy
diff --git a/...kpoints/full_ags_all_modes/learnt_filter_epochs_796_modes_all_pool_2_filters_4_size_4.npy b/...kpoints/full_ags_all_modes/learnt_filter_epochs_796_modes_all_pool_2_filters_4_size_4.npy
diff --git a/checkpoints/full_ags_all_modes/model_epochs_1044_modes_all_pool_1_filters_4_size_4.pt b/checkpoints/full_ags_all_modes/model_epochs_1044_modes_all_pool_1_filters_4_size_4.pt
diff --git a/checkpoints/full_ags_all_modes/model_epochs_1490_modes_all_pool_0_filters_0_size_0.pt b/checkpoints/full_ags_all_modes/model_epochs_1490_modes_all_pool_0_filters_0_size_0.pt
diff --git a/checkpoints/full_ags_all_modes/model_epochs_796_modes_all_pool_2_filters_4_size_4.pt b/checkpoints/full_ags_all_modes/model_epochs_796_modes_all_pool_2_filters_4_size_4.pt
diff --git a/notebooks/[Tutorial] Predicting affinity using ANTIPASTI.ipynb b/notebooks/[Tutorial] Predicting affinity using ANTIPASTI.ipynb