molmod/QuickFF
A Python code to quickly derive ab initio parameterized force fields.
Developer Profile
molmod
Discovered public repositories for molmod in the GitHub catalog.
molmod/yaff
Yaff is yet another force-field code
molmod/hipart
HiPart is a program to analyze the electronic structure of molecules with fuzzy-atom partitioning methods.
molmod/md-tracks
MD-Tracks is a statistical analysis toolkit for molecular dynamics and monte carlo simulations.
molmod/tamkin
TAMkin is a post-processing toolkit for thermochemistry and kinetics analysis.
molmod/zeobuilder
Zeobuilder is an extensible GUI-toolkit for molecular model construction.
molmod/molmod
MolMod is a collection of molecular modelling tools for python.