Re: [AMBER] [ inpcrd file ]

From: Gustaf Olsson <gustaf.olsson.lnu.se>
Date: Thu, 9 Jan 2020 11:40:35 +0000

Don’t forget the "setbox” command in leap

Best regards
// Gustaf

> On 9 Jan 2020, at 12:09, 조준범 <j1300704.gmail.com> wrote:
>
> Hi all,
>
> I tried to run EM, but AMBER says that
>
> | Flags:
> getting new box info from bottom of inpcrd
> | INFO: Old style inpcrd file read
>
> | peek_ewald_inpcrd: Box info not found in inpcrd
>
> How can I fix it?
>
> p.s. The inpcrd file was created by tleap
> --
>
> *Junbeom Cho*
>
> Integrated Ph. D. Student
>
>
>
> Theoretical and Computational Soft Matters Laboratory
>
> School of Chemical and Biological Engineering
>
> Seoul National University
>
> 1, Gwanak-ro, Gwanak-gu, Seoul, 08826, Korea
>
>
>
> Tel: +82-2-880-1529
>
> E-mail: cjb0704.snu.ac.kr
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Received on Thu Jan 09 2020 - 04:00:01 PST
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