Re: AMBER: old trajectory file (amber6) to new trajectory file ?

From: Carlos Simmerling <carlos.csb.sunysb.edu>
Date: Tue, 8 Jun 2004 07:37:48 -0400

unnatural base - RESP charges in ANTECHAMBERwhat is the "new trajectory format"? I don't think that
the trajectory format changed.
  ----- Original Message -----
  From: Difei Wang
  To: amber.scripps.edu
  Sent: Monday, June 07, 2004 10:55 PM
  Subject: AMBER: old trajectory file (amber6) to new trajectory file ?


  Dear All,

  I am wondering if it is possible to convert old trajectory file (amber6)
  to new trajectory file format(amber7). I need run mmpbsa but
  it needs the new format. For the prmtop file I can use xleap
  in amber7 to generate again. But it won't recognize the old coordinates
  files.

  Thanks.

  Difei
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Tue Jun 08 2004 - 12:53:00 PDT
Custom Search