[gmx-users] Saving PDB with Ligand from Docking

Nancy nancy5villa at gmail.com
Fri Oct 16 01:58:47 CEST 2009


I ran a docking simulation, and I have results in .mol format, and a protein
(.pdb format).  I would like to save both as a single PDB file, as input for
Gromacs.  Please advise as to what is the best way to do this.


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