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Atomu2014
/
MolCRAFT
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main
MolCRAFT
/
core
/
evaluation
/
utils
115 kB
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1 contributor
History:
1 commit
Atomu2014
demo init commit
1f0c7b9
about 2 years ago
__init__.py
Safe
8.73 kB
demo init commit
about 2 years ago
atom_num.py
Safe
732 Bytes
demo init commit
about 2 years ago
atom_num_config.py
Safe
13.1 kB
demo init commit
about 2 years ago
bond_analyze.py
Safe
5.53 kB
demo init commit
about 2 years ago
eval_atom_type.py
Safe
1.05 kB
demo init commit
about 2 years ago
eval_bond_angle.py
Safe
4.04 kB
demo init commit
about 2 years ago
eval_bond_length.py
Safe
3.79 kB
demo init commit
about 2 years ago
eval_bond_length_config.py
Safe
60.7 kB
demo init commit
about 2 years ago
eval_torsion_angle.py
Safe
5.98 kB
demo init commit
about 2 years ago
sascorer.py
Safe
6.06 kB
demo init commit
about 2 years ago
scoring_func.py
Safe
5.07 kB
demo init commit
about 2 years ago
similarity.py
Safe
456 Bytes
demo init commit
about 2 years ago
