Package schrodinger :: Package application :: Package desmond :: Package packages :: Package msys :: Module groups

Module groups

Functions

midpoint_violations(table, radius)

clone_buffer_violations(table, radius)
return atoms which violate Desmond's clone buffer restriction at the given radius for terms in the given table.

Variables

[hide private]

__package__ = 'schrodinger.application.desmond.packages.msys'