Hello.
I am trying to construct a unit containing my protein with ff99 atom types and
ligand with gaff atom types. To do this I run leap with the command
$xleap -s -f $AMBERHOME/dat/leap/cmd/leaprc.ff99
and then load gaff.dat with
>source gaff.dat
But it gives me a plenty of lines "ERROR: syntax error" after each line of
gaff.dat. So i can't save any parameter file.
It's very interesting that this problem appeared _after_ application of
bugfixes. Before application of bugfixes there were no such error. Are there
any solutions? Am i doing something wrong?
Best regards,
Dmitry Osolodkin
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Sun Mar 05 2006 - 06:10:12 PST
