[Chimera-users] command @/serialNumber=#

Francesco Pietra chiendarret at gmail.com
Sun Oct 12 00:05:10 PDT 2014


Hello:
I wonder whether it is possible to extend the command

sel @/serialNumber=18801 (as an example of a particular serial number)

to comprise a range of atoms. So as to cover, for example, an entire
ligand, may be dioxygen, 18801-18802. And whether that could be extended to
define a centroid.

it is implied that I have prepared a large system based on segname (charmm
ff with namd), which is not dealt with by chimera.

thanks

francesco pietra

PS: I can follow the ligand by defining the centroid for a single atom of
the ligand. This would be my last resource.
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