AMBER Archive (2004)

Subject: Re: AMBER: Why are there LENNARD_JONES_COEF A,B zero

From: David A. Case (
Date: Wed Apr 21 2004 - 10:57:26 CDT

On Wed, Apr 21, 2004, Xiao He wrote:

> This is one top file...
> Why are there LENNARD_JONES_COEF A,B zero?

Just sending a snippet from the prmtop file provides very little information,
other that there are indeed zero LJ coefficients in your file. Without
knowing something about how it was created, there is not any realistic chance
that anyone can tell you why this happened.



================================================================== David A. Case | e-mail: Dept. of Molecular Biology, TPC15 | fax: +1-858-784-8896 The Scripps Research Institute | phone: +1-858-784-9768 10550 N. Torrey Pines Rd. | home page: La Jolla CA 92037 USA | ================================================================== ----------------------------------------------------------------------- The AMBER Mail Reflector To post, send mail to To unsubscribe, send "unsubscribe amber" to