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Development release of the MiMiC framework (No replies)
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We are happy to announce the first development release of MiMiC, a framework for multiscale modeling in computational chemistry, currently capable of high-performance electrostatic embedding QM/MM MD simulations using CPMD and GROMACS.
Visit https://mimic-project.org/ for more information on how to get the source codes and how to build and install the MiMiC framework together with MiMiC-enabled CPMD (optionally with PLUMED support) and GROMACS. You will also find a tutorial guiding you through the first steps of running MiMiC-based QM/MM MD simulations.
More details about the MiMiC framework and the performance of the MiMiC-based QM/MM implementation can be found in the following publications:
Jógvan Magnus Haugaard Olsen (DTU), Simone Meloni (UniFe), Paolo Carloni (FZJ), Ursula Röthlisberger (EPFL)