Re: [AMBER] TI: error in reading namelist cntrl

From: <steinbrt.rci.rutgers.edu>
Date: Tue, 7 Feb 2012 07:44:55 -0500 (EST)

Hi,

> Thus, since DG and DC are not unique in dna, I useed crgmask =
> (:9.O6,H1,N2,H21,H22
> | :18.N4,H41,H42,H5).

on a single line, I assume? Try leaving out the brackets and quoting the
string.

> Can I use atom number rather than atom name? crgmask =
> '.269,271,273,274,275,553,555,556,557'. is it true?

that should work as well.

Thomas

Dr. Thomas Steinbrecher
formerly at the
BioMaps Institute
Rutgers University
610 Taylor Rd.
Piscataway, NJ 08854

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Received on Tue Feb 07 2012 - 05:00:02 PST
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