6 projects
kimmdy
Kinetic Monte Carlo Molecular Dynamics
kimmdy-dimerization
Reaction plugin for KIMMDY describing the dimerization of thymines in DNA
kimmdy-hydrolysis
Reaction plugin for KIMMDY that hydrolyses peptide bonds
kimmdy-hat
Hydrogen Atom Transfer Plugin for KIMMDY
kimmdy-reactions
Reaction template for KIMMDY
kimmdy-grappa
Parameterization interface between KIMMDY and GrAPPa