[gmx-users] pdb2gmx -merge non interactive

[Wojtyczka, André]

Hi List,

is it possible to have the -merge option in pdb2gmx set to non-interactive?

I need to merge 8 copies of a protein into one definition (.top) because if
i don't do that all the chains are included into the .top-file. It is then not
possible for me (in an easy way) to include my restraints into the same .top file
because that would lead to a wrong order.

To cut a long story short... I need -merge in a script and there i don't need
interactivity at all ;)

Thx for your time
André

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