On Wed, Aug 05, 2020, Nikhil Maroli wrote:
>we have made small individual unit and parameterised it with antechamber.
>Now we need to convert the simple mol2 file which is in sybyl mol2 format
>to amber atom type format. In amber type aromatic carbon is represented as
>ca, carboxy as c...
Sounds like you may just need a simple perl or python (or even sed) script to
change the atom types from what you have to what you want. Would that work?
...dac
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Received on Wed Aug 05 2020 - 13:30:03 PDT
