[gmx-users] pdb2gmx+ACE+NAC

Milan Melichercik melicher at cray.dbp.fmph.uniba.sk
Wed Jul 23 22:49:01 CEST 2003

hi all,
I have the protein, wthich begins with ACE and ends with NAC "aminoacid
residue" and I'm trying to convert it into .gro by pdb2gmx. But pdb2gmx
complains with this error message: 

"Fatal error: atom N not found in residue 1ACE while combining tdb and rtp".

What am I doing wrong?



More information about the gromacs.org_gmx-users mailing list