I am trying to send some arguments to tleap. Is there a way to pass
these through a script.
str1=loadpdb pdb100d.ent
savepdb str1 pdb100d.pdb
quit
I tried writing a file then redirecting input to it
tleap -f /usr/local/antechamber-1.27/dat/leap/cmd/leaprc.ff99SB < tleap.in
no luck
--
Jack
http://drugdiscoveryathome.com
http://hydrogenathome.org
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Received on Sat Nov 28 2009 - 20:00:02 PST
