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Evry-Paris-Saclay
Commits
f3f51a97
Commit
f3f51a97
authored
5 months ago
by
paradoxe-tech
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fixed param switch on l6
parent
07a8daa4
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model/sampler.py
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f3f51a97
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@@ -3,7 +3,7 @@ from .featurize import densify, featurize
from
pocketgen.utils.protein_ligand
import
PDBProtein
,
parse_sdf_file
from
pocketgen.utils.data
import
torchify_dict
def
interaction
(
ligand
_path
:
str
,
receptor
_path
:
str
)
->
torch
.
Tensor
:
def
interaction
(
receptor
_path
:
str
,
ligand
_path
:
str
)
->
torch
.
Tensor
:
"""
Convert PDB and SDF files into a set of protein-ligand interaction features.
@param ligand_path (str): path to the ligand SDF file.
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