[gmx-users] gromacs.org_gmx-users Digest, Vol 150, Issue 68

Timofey Tyugashev tyugashev at niboch.nsc.ru
Mon Oct 17 10:12:56 CEST 2016


As I understand it, QMMM actually works only with Gaussian and only with 
group cut-off scheme (deprecated in GROMACS5, no GPU support, limited 
multithreading).

> Date: Fri, 14 Oct 2016 17:14:36 -0400
> From: Xianchi Dong<dongxianchi at gmail.com>
> To:gromacs.org_gmx-users at maillist.sys.kth.se
> Subject: [gmx-users] QMMM install on GMX5.1
> Message-ID:<D4D77C48-E81C-4EEB-B75A-D01B10CD9EE4 at gmail.com>
> Content-Type: text/plain; charset=us-ascii
>
> Hi all,
> Does anyone know how to install qmmm code like mopac to gmx5.1?
>
> Best,
> Xianchi



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