From rino -A_T- ibc.wustl.edu Wed Sep 11 17:11:10 1996 Received: from wugate.wustl.edu for rino[ AT ]ibc.wustl.edu by www.ccl.net (8.7.5/950822.1) id QAA11357; Wed, 11 Sep 1996 16:29:43 -0400 (EDT) Received: from ibc.wustl.edu (ibc.wustl.edu [128.252.122.174]) by wugate.wustl.edu (8.7.5/8.7.3) with SMTP id PAA24570 for ; Wed, 11 Sep 1996 15:30:26 -0500 Received: by ibc.wustl.edu (SMI-8.6/SMI-SVR4) id PAA10605; Wed, 11 Sep 1996 15:30:23 -0500 Date: Wed, 11 Sep 1996 15:30:23 -0500 (CDT) From: Rino Ragno To: Computational Chemistry List Subject: H-bond FF parameters? Message-ID: MIME-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII Status: RO Content-Length: 1303 Dear netters, Maybe the following is a trivial question and I apologise for this. I would like to know if there is a parameter set to calculate H-bond interaction including halogens (Br, I, Cl and F). Any advice will be appreciated. Thank to all. Rino ++---------------------------------------------------------------------------++ ++---------------------------------------------------------------------------++ || || || Dr. Rino Ragno E-mail: rino[ AT ]wucmd.wustl.edu || || Institute for Biomedical Computing or: rino "-at-" ibc.wustl.edu || || Center for Molecular Design Phone : 314-362-2273 || || Box 8036, Washington University FAX : 314-362-0234 || || 700 South Euclid Avenue || || St. Louis, Missouri 63110 || || U. S. A. || || || ++---------------------------------------------------------------------------++ ++---------------------------------------------------------------------------++