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Scaffold Hunter is an accessible Java-based application built for the analysis of structure-related biochemical data.
The program is able to facilitate the interactive exploration of chemical space by enabling generation of and navigation in a scaffold tree hierarchy annotated with various data.
The graphical visualization of structural relationships allows to analyze large data sets.
Requirements:
· Java
What's New in This Release: [ read full changelog ]
· Added heuristic SAHN clustering for large datasets
· Improved clustering configuration panel
· Improved handling of binary fingerprints
· Updated Piccolo toolkit to version 1.3.1
· Fixed canonicalization of molecules/scaffolds to avoid duplicates
· Various minor improvements and bugfixes
· Please note that this release breaks compatibility with sessions created by previous versions of Scaffold Hunter. Old sessions can not be resumed!
