Dear Sir
I am studying the protein-ligand interaction by MMPBSA in xLeap.
When the following command is executed it shows the following error
saveAmberParm LIG lig.top lig.crd
Fatal error: For atom .R<lig 1>.A<02 11>Could not find vdW (or other)
parameter type: 0.3
saveAmberParm receptor rec.top rec.crd
Fatal error: Fatal Atom .R<LYS 948>.A<H2 24> does not have type.
How to debug these error.
Regards
Arunima
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Received on Thu Feb 27 2014 - 23:30:02 PST