Dear Mark,
I tried to make a hybrid [moleculetype] section that includes one protein and 4
ligands, it is very complicate way to do.
I have to do mannaully to put [atoms], [bonds], [pairs],
[angles] and [dihedral] for each ligand and need to re-number for all, if
not, the error of "Atoms in the .top are not numbered consecutively from
1" will be occured.
Do you have any more esier way to make a hybrid [moleculetype] ?
Beast regards,
pathum
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