[gmx-users] gromacs error
pawan raghav
pwnrghv at gmail.com
Mon Nov 30 18:01:49 CET 2009
I am using Gromacs on windows hen executing pdb2gmx command, I got an error
i.e.
Fatal error: Atom HD1 in residue HISB 3 not found in rtp entry with 14 atoms
while sorting atoms. May be different protonation state. Remove this
hydrogen or choose a different protonation state.
I want to know what is the error type and where is rtp entry.
--
Pawan
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