script for energy minimization of a .dcd file

From: sudipta (sudipta.mml_at_gmail.com)
Date: Fri Sep 03 2010 - 02:39:22 CDT

• Next message: Mert Gür: "Re: Does "rigidbond off" work instead of "rigidbonds none""
• Previous message: Leonardo Trabuco: "Re: Does "rigidbond off" work instead of "rigidbonds none""
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

Hi All,

        Is it possible to minimize each configuration of a .dcd file by
namd2? Any suggestion will be highly appreciated.

Thanks and regards
Sudipta

• Next message: Mert Gür: "Re: Does "rigidbond off" work instead of "rigidbonds none""
• Previous message: Leonardo Trabuco: "Re: Does "rigidbond off" work instead of "rigidbonds none""
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:54:29 CST