Re: xplor-formated parameters

From: Chris Harrison (
Date: Tue Dec 06 2011 - 12:41:05 CST


You should mail the namd-l list instead. The "namd" list is actually
for reporting bugs.

Why do you want them in xplor format? Namd accepts the charmm format.


Chris Harrison, Ph.D.
Theoretical and Computational Biophysics Group
NIH Resource for Macromolecular Modeling and Bioinformatics
Beckman Institute for Advanced Science and Technology
University of Illinois, 405 N. Mathews Ave., Urbana, IL 61801                          Voice: 773-570-0329              Fax:   217-244-6078
"Constantine, Keith" <> writes:
> Date: Tue, 6 Dec 2011 09:22:18 -0500
> From: "Constantine, Keith" <>
> To: "" <>
> Subject: xplor-formated parameters
> Dear Sir or Madam,
> Would it be possible to obtain the complete CHARMM22  or CHARMM27 parameter set used by NAMD in X-PLOR format. Any help with this would be greatly appreciated.
> Sincerely yours,
>     Keith Constantine
> Keith L. Constantine, Ph. D.
> Sr. Research Investigator II
> Mechanistic Biochemistry
> Bristol Myers Squibb Research and Development
> P.O. Box 4000
> Princeton, NJ 08543-4000
> Tel: (609)-252-6926
> Fax: (609)-252-6012
> e-mail:
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