Re: [gmx-users] Remove the water from the crystal structure of Protein in PDB file

Chih-Ying Lin wrote: Hi The protein is in the crystal structure. So, the PDB file includes some water molecules. Could I just remove those water molecules?? Some kinds of waters, yes. It sounds like you should go and do some tutorial material - because this sort of issue gets treated in t

[gmx-users] Remove the water from the crystal structure of Protein in PDB file

Hi The protein is in the crystal structure. So, the PDB file includes some water molecules. Could I just remove those water molecules?? Thank you Lin ___ gmx-users mailing listgmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-user