Pinned Repositories
cp2k
Quantum chemistry and solid state physics software package
cp2k
Quantum chemistry and solid state physics software package
gufe
grand unified free energy by OpenFE (updated proteincomponent.py, more metal ions)
kartograf
This package contains tools for setting up hybrid-topology FE calculations
plumed2
Development version of plumed 2 (Puck7N)
gufe
grand unified free energy by OpenFE
Mert-csrg's Repositories
Mert-csrg/cp2k
Quantum chemistry and solid state physics software package
Mert-csrg/gufe
grand unified free energy by OpenFE (updated proteincomponent.py, more metal ions)
Mert-csrg/kartograf
This package contains tools for setting up hybrid-topology FE calculations
Mert-csrg/plumed2
Development version of plumed 2 (Puck7N)