New communication mechanism

bharurn / mimicpy

Python based tools for preparing MiMiC QM/MM simulations

GNU General Public License v3.0

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Closed bharurn closed 4 years ago

bharurn commented 4 years ago

Change simulate.MiMiC to support new communication mechanism. Check for old one with MCL_COMM also.

bharurn commented 4 years ago

Closing this as simulate functionalities will be removed.