On Fri, Jun 29, 2012, Sanjib Paul wrote:
> I am new in AMBER. For a test run I wanted to simulate
> unit "CHCL3BOX" given in residue template. But when I am going to create
> prmtop and inpcrd file in xleap, error messages are coming like "....could
> not find atom type CL".
Sounds like you are not loading the frcmod.chcl3 file:
loadAmberParams frcmod.chcl3
should do the trick.
...dac
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Received on Sat Jun 30 2012 - 05:30:03 PDT
