Factual package intelligence from PyPI

torchdock 0.1.0 package intelligence

PyTorch-based differentiable molecular docking framework

pip install torchdock

Current version
0.1.0
Python requirement
>=3.10
License
Apache-2.0
Distribution type
Pure Python wheel
Release files
2 (1 wheels, 1 source)
Download size
472.4 KiB
Release history
1 releases with files
Median release cadence
Not enough dated releases

torchdock dependencies

PyPI declares 16 unique dependency rules for this release. Environment markers are shown when supplied by the project.

  1. torch >=2.0
  2. numpy >=1.24
  3. scipy >=1.10
  4. pandas >=2.0
  5. scikit-learn >=1.3
  6. pyyaml >=6.0
  7. tqdm >=4.60
  8. biopython >=1.80
  9. rdkit >=2023.09
  10. xgboost >=2.0
  11. matplotlib >=3.7
  12. spyrmsd >=0.6
  13. smac >=2.0

Compatibility and release files

torchdock publishes 1 wheel and 1 source archive for version 0.1.0. Wheel platform tags: any.

Declared Python classifiers: 3.10, 3.11, 3.12.

Release activity and sources

PyPI lists 1 release with files. The first dated release is ; 1 release falls within the 365 days preceding the latest dated release. The current release files were uploaded on .