PyRank

Molecular Python Packages

Python packages with the GitHub topic molecular. Sorted by monthly downloads, with stars and forks.
keiserlab
e3fp

3D molecular fingerprints

49K 144 34
bradyajohnston
molecularnodes

Toolbox for molecular animations in Blender, powered by Geometry Nodes.

3K 1K 133
napoles-uach
stmol

This is the repository for the Stmol project, a Streamlit component that uses py3Dmol to render molecules.

2K 213 36
dftlibs
numgrid

Numerical integration grid for molecules.

1K 52 14
tommysisk
writhe-tools

A high-performance Python package for computing the geometric descriptor writhe from 3D coordinate data.

896 20 10
sunghunbae
desmondtools

Tools for Schrodinger Desmond

222 0 0
edahelsinki
xiplot

Web-first Visualisation platform for Multidimensional Data

101 19 2
edahelsinki
xiplot-filetypes

Web-first Visualisation platform for Multidimensional Data

45 19 2