Subject: Re: CCL:Partial charges & mol2

From: "Asim Kumar Debnath" <[email-masked]>
Date: Thu, 25 Feb 1999 10:11:52 -0500

Dear Martin:
	You can use the program, chunks, which comes with the dock program. It
calculates Gasteiger-Marsili charges for mol2 files. In dock3.5 the program is
located at /dock3.5/source/database/sdf2mol2/chunks. In Dock4.0, it is located
at /dock4.0/dock4/source/databse/chunks.
	Hope this helps. Good luck.

Asim

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