Re: [AMBER] Fortran runtime error:

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From: Ephraim Marondedze <ephraimm18.gmail.com>
Date: Sat, 29 May 2021 08:09:03 +0200

Thanks. I switched to Amber 20 and my simulations are running fine.

Regards.

Ephraim Marondedze
Computational Chemistry PhD
University of Johannesburg

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On Fri, May 28, 2021 at 4:12 PM David A Case <david.case.rutgers.edu> wrote:

> On Fri, May 28, 2021, Ephraim Marondedze wrote:
>
> >At line 718 of file mdin_ctrl_dat.F90 (unit = 5, file = 'ti001.prod.in')
> >Fortran runtime error: Cannot match namelist object name gti_add_sc
>
> First, check the syntax in the namelist sections of ti001.prod.in, looking
> for possible errors involving gti_add_sc (or perhaps the variable just
> before it.)
>
> It's also worth reporting what version of pmemd you are using: the
> git_add_sc variable didn't show up until Amber20.
>
> ...dac
>
>
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Received on Fri May 28 2021 - 23:30:02 PDT