Becksteinlab/GromacsWrapper
GromacsWrapper wraps system calls to GROMACS tools into thin Python classes (GROMACS 4.6.5 - 2024 supported).
PythonGPL-3.0
Watchers
- alashkov83FSRC "Crystallography and Photonics" RAS
- diallobakary4Grahamstown
- ernie2k
- frchalaouxfrcopter
- hovo1990
- iorgaInstitut de Chimie des Substances Naturelles, CNRS, Gif-sur-Yvette, France
- jhcloos
- liusong299Hong Kong University of Science and Technology (HKUST)
- MichalKononenkoInstitute for Quantum Computing
- orbeckstArizona State University
- VF1979
- whiteadUniversity of Rochester/FutureHouse