Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates
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Updated
Oct 14, 2024 - Python
Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates
Conversion of coarsegrain to atomistic (complete rewrite of the original CG2AT)
Modeling the synthesis of SILica materials VIA multiscale computer simulation. (implementation in MARTINI forcefield)
This repository contains the tools to build the Martini 3 version of graphene (structure and ITP files)
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