parameterizing novel molecule

From: Dhiraj Srivastava (
Date: Wed Sep 06 2006 - 01:52:47 CDT

   does any one has step by step procedure for parameterizing a novel
molecule? specially how can i determine min. interaction energy and
geometry between my molecule and water?

Dhiraj Kumar Srivastava
Department of Chemistry
University of Missouri-Columbia
MO, 65211
Ph. no. 001-573-639-0153

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