18 Jul
2000
18 Jul
'00
2 p.m.
Hi,
It probably means that there is such a residue which does not have an entry in the used topology library. include in your top file SET OUTPUT_CONTROL = 1 1 1 1, it will give you more detailed log file possibly reporting the problematic residue.
Andras
"J.U. Flanagan Biomedical Research Centre" wrote: > > Hi all, > > Could anyone tell me what this error message is indicative of, and how I > can fix it? > > iup2crm_E> IUPAC atom not found in topology library: CG > iup2crm_E> residue type undefined > recover__> MODELLER_STATUS >= STOP_ON_ERROR: 1 1 > > Thanks in advance > > Jack
--
,
Andras Fiser, PhD # phone: (212) 327 7206
The Rockefeller University # fax: (212) 327 7540
Box 270, 1230 York Avenue # e-mail:fisera@rockefeller.edu
New York, NY 10021-6399, USA # http://salilab.org/~andras