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Uni-Dock: a GPU-accelerated molecular docking program
rifdock / rifdock
Forked from bcov77/schemeRifdock Library for Conformational Search
Vina-GPU 2.0 accelerates AutoDock Vina and its related commonly derived docking methods, such as QuickVina 2 and QuickVina-W with GPUs.
Exact optimization for cost function networks and additive graphical models
Evolutionary conservation estimation of residues or nucleotides
PARENT: a parallel software suite for the calculation of configurational entropy in biomolecular systems
a fast and accurate physical energy function for predicting protein stability and protein-protein affinity changes upon amino-acid mutations
Repository of the data for the PLUMED Masterclass 22.9