BruDiGe
Molecular Modelling. Molecular dynamics, computer-aided drug design, and allosterism. I used software, not created them. I was a PhD student in a past life.
Pinned Repositories
cMD
Scripts to run conventional MD simulations in AMBER (PLUMED link)
tutorial-MD
Tutorial MD simulations
BruDiGe's Repositories
BruDiGe/cMD
Scripts to run conventional MD simulations in AMBER (PLUMED link)