Re: [gmx-users] QM/MM simulations (Mark Abraham) (Groenhof, Gerrit) (Clinton King)

2016-09-01 Thread Groenhof, Gerrit
2016 13:28:56 -0600 From: Clinton King <clintonkin...@chem.byu.edu> To: gromacs.org_gmx-users@maillist.sys.kth.se Subject: [gmx-users] QM/MM simulations (Mark Abraham) (Groenhof, Gerrit) Message-ID:

[gmx-users] QM/MM simulations (Mark Abraham) (Groenhof, Gerrit)

2016-08-31 Thread Clinton King
Is is true that the gau script available at http://wwwuser.gwdg.de/~ ggroenh/qmmm.html only works with gromacs versions < 5? -- Clinton King Graduate Student Chemistry Department Brigham Young University > > >5. Re: QM/MM simulations (Mark Abraham) (Groenhof, Gerrit) > > Hi, > > Unless there