Ecosyste.ms: Repos
An open API service providing repository metadata for many open source software ecosystems.
GitHub topics: molecular-dynamics-simulations
andthum/lintf2_ether_ana_postproc
Analysis postprocessing utilities for my molecular dynamics simulations of LiTFSI-Ether mixtures
Language: Python - Size: 1.2 MB - Last synced: 28 days ago - Pushed: 28 days ago - Stars: 0 - Forks: 0
choderalab/pymbar
Python implementation of the multistate Bennett acceptance ratio (MBAR)
Language: Python - Size: 29 MB - Last synced: 19 days ago - Pushed: 2 months ago - Stars: 219 - Forks: 89
kohnakagawa/lj_gpu
SIMTization for Force Calculation of Lennard-Jones Potential
Language: CSS - Size: 645 KB - Last synced: 10 months ago - Pushed: over 6 years ago - Stars: 1 - Forks: 0
SchifferLab/ROBUST
Tools to calculate descriptors from molecular dynamics and it's application to predict drug resistance.
Language: Python - Size: 46 MB - Last synced: 12 months ago - Pushed: over 1 year ago - Stars: 10 - Forks: 4
malramsay64/Dynamics
Project to understand the dynamics of a 2D mickey-mouse like trimer molecule
Language: Python - Size: 26.8 MB - Last synced: over 1 year ago - Pushed: almost 4 years ago - Stars: 1 - Forks: 0
