SolvationTools

SolvationTools's repositories

SSTMap

Solvation Structure and Thermodynamic Mapping

Language:PythonMIT38 8 49

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++MIT3 5 1

Small_Molecule_Solvation

Study small molecule solvation by PME-GIST

3 3 1

COVID19_GIST_HSA

The Solvation Mapping on COVID19 related Protein Targets

Language:ShellMIT2 3 1

sstmap_test_suite

Test systems for SSTMap

Language:Python2 2 1

covid

MolSSI SARS-CoV-2 Biomolecular Simulation Data and Algorithm Store

Language:HTML010

cpptraj

Biomolecular simulation trajectory/data analysis.

Language:C++NOASSERTION040

HSA-Most-Probable-Water-Orientation

Code to find the most probable orientations in each HSA cluster

Language:Python030