From robert -x- at -x- pauli.utmb.edu  Mon Sep 23 15:36:29 1996
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From: "Robert Fraczkiewicz" <robert $#at#$ pauli.utmb.edu>
Message-Id: <9609231336.ZM10061 "-at-" pauli.utmb.edu>
Date: Mon, 23 Sep 1996 13:36:11 -0500
In-Reply-To: Zhou Feng <zfeng \\at// mdh.BIM.ANL.GOV>
        "CCL:(no subject)" (Sep 23, 11:32am)
References: <199609231632.QAA00698 ":at:" pyp.bim.anl.gov>
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To: Zhou Feng <zfeng;at;mdh.BIM.ANL.GOV>, chemistry;at;www.ccl.net
Subject: Re: CCL:(no subject)
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On Sep 23, 11:32am, Zhou Feng wrote:
> Subject: CCL:(no subject)
> Hi:
>
>  I am looking for a reasonably accurate implicit solvation energy program
which
> can do some simple energy minimization or low temperature MD to predict the
> energies of a biomoleular system, there are moderate conformational changes
> which has to be predicted along with the energies. IS there anyone who can
give
> me some suggestions?  We have CHARMM & Delphi, but we need to do some
dynamics
> with the implicit solvent model.
>
> Feng Zhou
> Argonne National Lab.

An excellent program FANTOM written by Werner Braun and co-workers can do
that. Please, refer to the following web page for information:

http://www.hbcg.utmb.edu/faculty/braun/fm_home.html

FANTOM is free of charge for academic users.

Regards,

Robert Fraczkiewicz,
University of Texas Medical Branch