[gmx-users] Linking Gamess-US with gromacs

Alex nedomacho at gmail.com
Mon Jun 29 08:44:28 CEST 2015


Can you please post a link to what you read on the gromacs website?

Thanks,

Alex

AB> I want to perform QM/MM calculations using gromacs and Gamess-US packages.
AB> But from the gromacs website i found that only Gromacs-UK, MOPAC and
AB> Gaussian are in gromacs.

AB> I just want to know, that is there a way to link gromacs with Gamess-US.

AB> Thank you
AB> With Regards
AB> Akshay Bhatnagar
AB> PhD Student
AB> BITS Pilani Hyderabad Campus







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