Hello,
Is there a good example in the API docs which illustrates how to modify a
molecule?
For example, if I read in a mol2 into OB and wish to delete a carbon atom,
replace it with an oxygen and re-write that into a new file (that has all the
carbon’s extra hydrogens deleted and in general a chemically correct molecule).
Something in those lines.
In advance --Thanks very much for your help!
Rgds,
Prashanth --
Prashanth Athri
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