From: Axel Kohlmeyer (akohlmey_at_cmm.chem.upenn.edu)
Date: Fri May 29 2009 - 16:28:41 CDT
On Fri, 2009-05-29 at 16:56 -0400, KIRTANA S wrote:
> I have attached my parameter file , which I am using to run my
there is no attachment, but nevermind.
> simulation , it giving error as
> FATAL ERROR: BAD ANGLE FORMAT IN CHARMM PARAMETER FILE
> LINE=*gold sulphur section 2*
this already tells you where the error is. just search
for this line. looks like you forgot to use comment characters
> I am first time user of NAMD , and unable to figure it out.This file
> was created manually since I am using gold in my structure.
-- ======================================================================= Axel Kohlmeyer akohlmey_at_cmm.chem.upenn.edu http://www.cmm.upenn.edu Center for Molecular Modeling -- University of Pennsylvania Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323 tel: 1-215-898-1582, fax: 1-215-573-6233, office-tel: 1-215-898-5425 ======================================================================= If you make something idiot-proof, the universe creates a better idiot.
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