RE: cellBasisVectors and xsc files

From: Wei Chen (gtg553p_at_mail.gatech.edu)
Date: Wed Jul 20 2005 - 10:47:21 CDT

Actually, I think extendedSystem command will override. Look at the userguide
P.61.

Wei Chen

Quoting JC Gumbart <gumbart_at_ks.uiuc.edu>:

> I believe since the file is parsed linearly that the cellBasisVectors would
> override the xsc file. I'm surprised though that it doesn't throw an error
> when you try to do this.
>
>
> -----Original Message-----
> From: owner-namd-l_at_ks.uiuc.edu [mailto:owner-namd-l_at_ks.uiuc.edu] On Behalf
> Of Stern, Julie
> Sent: Tuesday, July 19, 2005 8:53 PM
> To: namd-l_at_ks.uiuc.edu
> Subject: namd-l: cellBasisVectors and xsc files
>
> If you listed both the cellBasisVectors and
> the restart with extendedSystem which one
> takes precedence? Does the extendedSystem
> override the cellbasisvectors or vice versa?
>
> Thajks.
>
>
>

--

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:39:42 CST