> Dear amber committee
> I am using the ff02 polarizable force field, why I cannot load the NHE
residue? My leapin is following
source leaprc.ff02pol.r1
set default PBradii mbondi2
pep = sequence {NSER TRP THR TRP GLU ASN GLY LYS TRP THR TRP LYS NHE }
savepdb pep peptide_linear.pdb
saveamberparmpol pep pep.top pep.crd
quit
but the error is :sequence: Illegal UNIT named: NHE
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Received on Tue Jul 13 2010 - 08:00:03 PDT
