Hi all,
I know I've posted again but got no help. I thought I would try again. In any version of the leap program I'm unable to set the atom types on a unit. For example, I'm using the GLYCAM06 parameter sets. If I was to make a sequence like "x = sequence { ROH 0GB }", I cannot change the head and tail atoms via "set x head x.2.O2" or "set x tail x.2.O2" for example. Any ideas?
--
Alex Boncheff
MSc. Candidate
Department of Chemistry
University of Guelph
Guelph, ON, Canada
N1G 2W1
Office: MacNaughton 233
T: 519-824-4120 x 58111
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Received on Tue May 25 2010 - 09:00:06 PDT
