AMBER Archive (2006)

Subject: AMBER: leap usage

From: Stefano Federico Massimiliano Pieraccini (Stefano.Pieraccini) (Stefano.Pieraccini_at_unimi.it)
Date: Thu Nov 02 2006 - 03:41:34 CST

Dear Amber Users,

  We would like to create a series of .top files from pdb files having one
mutation each. Is it possible to use leap in a non interactive way, so that it
is possible to create the files automatically (with some scripting) without
opening manually every single pdb file?

 Thank you in advance

 Stefano Pieraccini
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