KNIME Optimization extension version 3.6.0.v201805181414 by KNIME AG, Zurich, Switzerland
Maximum-Score Diversity Selection for Early Drug Discovery , Journal of Chemical Information and Modeling, vol. 51, no. 2, pp. 237-247, 2011; Doi: 10.1021/ci100426r .An example of how to use this node can be found on the example workflow server.
To use this node in KNIME, install KNIME Optimization extension from the following update site: