andysim/openmm
OpenMM is a toolkit for molecular simulation using high performance GPU code.
Simple code snippets demoing linking Python and C++, using CMake to build.
Public repository record indexed from GitHub. Explore verified star velocity metrics, source code repositories, and curated developer tool directories across the GitHubRepo ecosystem.
OpenMM is a toolkit for molecular simulation using high performance GPU code.
Public repository.
Code snippets to aid the implementation of spherical harmonic multipole energies, forces and torques.
Systematic force field optimization.