An open API service providing package, version and dependency metadata of many open source software ecosystems and registries.

pypi.org "Lennard-Jones" keyword

rgpot 3.5.1
Potential energy surfaces for atomistic simulation (LJ + Metatomic multi-ABI dlopen; nanobind abi3)
18 versions - Latest release: 26 days ago - 1.28 thousand downloads last month - 4 stars on GitHub - 1 maintainer
shakir-mntf 1.0.2
GPU-accelerated Molecular Dynamics Simulation Software by Abdul Haseeb Shakir
3 versions - Latest release: 7 months ago - 67 downloads last month - 0 stars on GitHub - 1 maintainer
dompap 0.0.5
Simulations of point-like particles in any dimension with any pair potential
5 versions - Latest release: almost 3 years ago - 17 downloads last month - 0 stars on GitHub - 1 maintainer