[gmx-users] Bug #554: pdb2gmx proton naming compliancy
MKibalchenko at mednet.ucla.edu
Tue Dec 3 23:33:15 CET 2013
does anyone know what was the resolution of this bug?
How does one handle pdb2gmx with PDB files and avoid errors like this?
Atom HB3 in residue ASP 2 was not found in rtp entry ASP with 14 atoms
while sorting atoms.
Mikhail Kibalchenko, PhD
mkibalchenko at mednet.ucla.edu<mailto:mkibalchenko at mednet.ucla.edu>
Postdoctoral Scholar, Neurology
David Geffen School of Medicine at UCLA
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