FastROCS TK 1.8.4¶
A new Python example script, BestShapeOverlayMultiConfQuery.py, has been added to perform a query search for every conformer of the query molecule and save the sorted results sequentially in a single file for each query molecule.
Minor bug fixes¶
A small modification has been made to
ShapeDatabaseServer.pyto reduce the number of server-related messages when running a query search via the client/proxy interface.