From chemistry-request@server.ccl.net  Sun Sep  3 18:37:52 2000
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Date: Sun, 3 Sep 2000 18:37:42 -0400 (EDT)
From: "Xiang(Simon) Wang" <simwang@chem.ufl.edu>
To: CHEMISTRY@ccl.net
Subject: I/O in Charmm
Message-ID: <Pine.GSO.4.10.10009031825190.18137-100000@chem.ufl.edu>
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Dear CCLers:

Can someone help me on how to read small molecule structure in Charmm?
For example, phosphoribosyldiphosphate (PRPP), which can not be found in
top_all22_model.inp file. I could get the PSF file from InsightII. But
when running, Charmm gave the warning of lacking of parameters. Can
someone help me out of it?

Thanks a lot,

X. Wang


