Factual package intelligence from PyPI

strain-relief 0.5 package intelligence

Calculates ligand strain of small molecules from their docked poses.

pip install strain-relief

Current version
0.5
Python requirement
>=3.11
License
Apache-2.0
Distribution type
Pure Python wheel
Release files
2 (1 wheels, 1 source)
Download size
11.4 MiB
Release history
3 releases with files
Median release cadence
134 days

strain-relief dependencies

PyPI declares 17 unique dependency rules for this release. Environment markers are shown when supplied by the project.

  1. rdkit
  2. ase
  3. numpy
  4. pandas
  5. omegaconf
  6. hydra-core
  7. pyarrow
  8. fastparquet
  9. universal-pathlib
  10. boto3
  11. loguru
  12. mace-torch
  13. rich

Compatibility and release files

strain-relief publishes 1 wheel and 1 source archive for version 0.5. Wheel platform tags: any.

No version-specific Python classifiers are declared.

Release activity and sources

PyPI lists 3 releases with files. The first dated release is ; 3 releases fall within the 365 days preceding the latest dated release. The current release files were uploaded on . The preceding dated release was .