Projects

Scientific Software

Updated 10 months ago

Chitin Builder: a VMD tool for the generation of structures of chitin molecular crystals for atomistic simulations - Published in JOSS (2024)

chitin md vmd

Earth and Environmental Sciences (40%)

Scientific Software · Peer-reviewed

Updated 10 months ago

Collective variables library for molecular simulation and analysis programs

collective-variables enhanced-sampling free-energy gromacs lammps molecular-dynamics namd simulation tinkerhp vmd

ecosyste.ms