Stefan Hervø-Hansen's repositories
SI-Cavity-Formation
SI for the article named "Free-energy decomposition of salt effects on the solubilities of small molecules and the role of excluded-volume effects"
SI-Excluded-Volume-Formation
SI for the article named "Free-energy decomposition of salt effects on the solubilities of small molecules and the role of excluded-volume effects"
Caffeine_solubility
SI for Caffeine Solvation in Electrolyte Solutions.
formamide_parameterization
SI for formamide paramerterization paper
Language:Jupyter Notebook000
openmm
OpenMM is a toolkit for molecular simulation using high performance GPU code.
Language:C++000
Protein-Electrostatics
Odds and Ends in Protein Electrostatics
Language:TeXMIT000