Alessandri Group
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- metadpmf Public
metadpmf is a Python package for setting up, running, and analysing Metadynamics simulations in GROMACS+PLUMED to compute potentials of mean force (PMFs) of dimerization
- PQT12 Public
Martini 3 CGMD inputs and GIWAXS simulation files for PQT polymorphism in organic thermoelectrics
- Martini3-small-molecules Public Forked from Martini-Force-Field-Initiative/M3-Small-Molecules
Martini 3 small-molecule database
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