From rsjuds#* at *#california.sandia.gov  Tue Apr  2 12:20:24 1996
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From: rsjuds ":at:" california.sandia.gov (judson richard s)
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Subject: Internal coordinat MD codes
To: CHEMISTRY {*at*} www.ccl.net
Date: Tue, 2 Apr 1996 09:15:56 -0800 (PST)
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I am looking for information on MD/MM codes that work in internal
(dihedral coordinates) and that calculate analytic gradients (dE/dphi,
where phi is a dihedral), and that also return the total energy. I'd
appreciate any information on code names and availabilities that you
could provide.

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| Richard Judson				|
| Center for Computational Engineering, MS 9214	|
| Sandia National Laboratories			|
| Livermore, CA 94551-0969			|
| (510)294-1438					|
| (510)294-2234 (FAX)				|
| email: rsjuds*- at -*ca.sandia.gov			|
|						|
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