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An open API service indexing awesome lists of open source software.

Projects in Awesome Lists tagged with electron-density

A curated list of projects in awesome lists tagged with electron-density .

https://github.com/ifilot/dftcxx

C++ based DFT program for educational purposes

dft electron-density quantum-chemistry

Last synced: 15 Feb 2026

https://github.com/uglymol/uglymol

Macromolecular viewer for crystallographers (WebGL)

ccp4 crystallography electron-density macromolecular-crystallography molecular-graphics webgl

Last synced: 23 Feb 2026

https://github.com/ifilot/edp

Electron Density Plotter

color-scheme density electron-density vasp visualization

Last synced: 15 Feb 2026

https://github.com/peterspackman/chmpy

Spherical harmonic shape descriptors, promolecule densities, isosurfaces and Hirshfeld surfaces in python

crystallography descriptor descriptor-learning electron-density hirshfeld-surface isosurface machine-learning-library promolecule

Last synced: 12 Sep 2025

https://github.com/theochem/cugbasis

High performance CUDA/Python library for computing quantum chemistry density-based descriptors for larger systems using GPUs.

atoms-in-molecules computational-chemistry conceptual-dft cuda electron-density gpu python qtaim quantum quantum-chemistry theoretical-chemistry

Last synced: 17 Jan 2026

https://github.com/ccr-cheng/InfGCN-pytorch

Official implementation of the NeurIPS 23 spotlight paper of ♾️InfGCN♾️.

electron-density equivariance equivariant-network graphon neural-operator

Last synced: 23 Aug 2025