RE: leap remove command

From: CUI, Guanglei <>
Date: Mon, 17 Mar 2003 00:30:44 -0500 (EST)

Dear all,
    Thank Darden and Duan for answering my question. After diff the two
    topology files I have, I found it's something else, not the solvent.
    remove command in leap seems to work correctly. The IFBOX > 0 part
    from the two topology files are identical. I think one can manually
    edit this section of the topology file to fix the number of solvent,
    like in creating belly topology when having a multimolecular solute,
    for example double strand DNA. Am I right?

Guanglei Cui
Dept. of Chemistry
SUNY at Stony Brook
Stony Brook, NY 11790
Received on Mon Mar 17 2003 - 05:53:01 PST
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