Re: Reload molecular topology for amber files?

From: David Hardy (dhardy_at_ks.uiuc.edu)
Date: Fri Jun 28 2019 - 12:12:57 CDT

Hi Norman,

There are presently no plans to implement structure reloading for Amber files.

I'll keep in mind that there is interest in doing so.

Best regards,
Dave

--
David J. Hardy, Ph.D.
Beckman Institute
University of Illinois at Urbana-Champaign
405 N. Mathews Ave., Urbana, IL 61801
dhardy_at_ks.uiuc.edu, http://www.ks.uiuc.edu/~dhardy/
> On Jun 27, 2019, at 6:52 AM, Norman Geist <norman.geist_at_uni-greifswald.de> wrote:
> 
> Dear experts,
>  
> in NAMD 2.12 the structure keyword has been changes to allow updates of the topology PSF of the system. Are there plans to implement this also for the parmfile keyword for amber files?
>  
> Bests
> Norman Geist

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