Swarm-CG: Automatic Parametrization of Bonded Terms in MARTINI-based Coarse-Grained Models of Simple to Complex Molecules via Fuzzy Self-Tuning Particle Swarm Optimization
Hi, I'd like to use your model to optimize bonded parameters for a drug molecule. Just wanted to check if your tool is compatible with the latest version of gromacs (2021) and does it currently handle virtual sites?
Hi, I'd like to use your model to optimize bonded parameters for a drug molecule. Just wanted to check if your tool is compatible with the latest version of gromacs (2021) and does it currently handle virtual sites?