SolvationTools

Pinned Repositories

covid
MolSSI SARS-CoV-2 Biomolecular Simulation Data and Algorithm Store
Language:HTML0 1 00
COVID19_GIST_HSA
The Solvation Mapping on COVID19 related Protein Targets
Language:Shell2 3 14
cpptraj
Biomolecular simulation trajectory/data analysis.
Language:C++0 4 00
Gist-Post-Processing
Stable release public github repository for Gist-Post-Processing, a codebase designed to assist users in evaluating gist quantities or .dx maps in general
Language:C++3 5 14
HSA-Most-Probable-Water-Orientation
Code to find the most probable orientations in each HSA cluster
Language:Python0 3 01
Small_Molecule_Solvation
Study small molecule solvation by PME-GIST
3 3 11
SSTMap
Solvation Structure and Thermodynamic Mapping
Language:Python38 8 4923
sstmap_test_suite
Test systems for SSTMap
Language:Python2 2 13

SolvationTools's Repositories

KurtzmanLab/SSTMap
Solvation Structure and Thermodynamic Mapping
Language:Python38 8 4923
KurtzmanLab/Gist-Post-Processing
Stable release public github repository for Gist-Post-Processing, a codebase designed to assist users in evaluating gist quantities or .dx maps in general
Language:C++3 5 14
KurtzmanLab/Small_Molecule_Solvation
Study small molecule solvation by PME-GIST
3 3 11
KurtzmanLab/COVID19_GIST_HSA
The Solvation Mapping on COVID19 related Protein Targets
Language:Shell2 3 14
KurtzmanLab/sstmap_test_suite
Test systems for SSTMap
Language:Python2 2 13
KurtzmanLab/covid
MolSSI SARS-CoV-2 Biomolecular Simulation Data and Algorithm Store
Language:HTML0 1 00
KurtzmanLab/cpptraj
Biomolecular simulation trajectory/data analysis.
Language:C++0 4 00
KurtzmanLab/HSA-Most-Probable-Water-Orientation
Code to find the most probable orientations in each HSA cluster
Language:Python0 3 01