primaryodors / primarydock

PrimaryOdors.org molecular docker.
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MEASURE command for finding interatomic distances in Pepteditor. #375

Closed primaryodors closed 9 months ago

primaryodors commented 9 months ago

There is now a MEASURE command which takes two residues, or two pairs of residue and atom name, as arguments, followed by an output variable of type float. Its function is to measure the distance in Angstroms between the two atoms and store the result in the output var.