OpenEye Toolkits
OpenEye has released OpenEye Toolkits v2015.June. This release includes a new application programming interface for automatically classifying and separating various components of macromolecular complexes by their functional roles. It also includes an implementatation of the Baell and Holloway's classification of substrucures that are associated with assay false positives; and custom ring template dictionaries which let users quickly add funtionality to 2D depictions.