quick fix

lucidrains · Sep 29, 2024 · 07de8ab · 07de8ab
1 parent a2592f1
commit 07de8ab
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diff --git a/alphafold3_pytorch/alphafold3.py b/alphafold3_pytorch/alphafold3.py
@@ -5705,6 +5705,7 @@ def calc_atom_access_surface_score(
 
         # atom_rel_pos = einx.get_at('i [m] c, i j -> i j c', atom_rel_pos, include_indices)
 
+        include_in_free_calc = include_in_free_calc.bool()
         atom_rel_pos = atom_rel_pos.gather(1, repeat(include_indices, 'i j -> i j c', c = 3))
         target_atom_radii_sq = atom_radii_sq[include_indices]
 

diff --git a/pyproject.toml b/pyproject.toml
@@ -1,6 +1,6 @@
 [project]
 name = "alphafold3-pytorch"
-version = "0.5.53"
+version = "0.5.54"
 description = "Alphafold 3 - Pytorch"
 authors = [
     { name = "Phil Wang", email = "[email protected]" },