Pinned Repositories
AutoDock-GPU
AutoDock for GPUs and other accelerators
ProLIF
Interaction Fingerprints for protein-ligand complexes and more
gnina
A deep learning framework for molecular docking
lightdock
Protein-protein, protein-peptide and protein-DNA docking framework based on the GSO algorithm
mdanalysis
MDAnalysis is a Python library to analyze molecular dynamics simulations.
mdtraj
An open library for the analysis of molecular dynamics trajectories
msmbuilder2022
Statistical models for biomolecular dynamics
viamd
Visual Interactive Analysis of Molecular Dynamics
hdbscan
A high performance implementation of HDBSCAN clustering.
xavgit
Config files for my GitHub profile.
xavgit's Repositories
xavgit/xavgit
Config files for my GitHub profile.