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Technology and Contributor Credits Implementation Team Lead implementor: Frank Oellien, Computer-Chemie-Centrum, Institute of Organic Chemistry, Univ. of Erlangen-Nuremberg, Germany Support: M. Nicklaus at LMCh/NCI, Bethesda/Frederick, MD, USA and W.D. Ihlenfeldt from the university Erlangen-Nuremberg. We thank Gary Mallard from NIST for providing us with additional compound names. Database generation and search functionality by CACTVS universal chemistry information handling system by W. D. Ihlenfeldt Novartis JME Java structure editor by P. Ertl Computed logP values and life links into property prediction services by ACD Labs. More than 200,000 IUPAC names calculated by ACD/Name v. 4.0 Drug-likeness prediction by M. Wagener at Organon PASS drug activity/inactivity prediction by V. Poroikov 3D conformer data set generated by MSI Catalyst modelling program 3D base conformation data generated by Molecular Networks CORINA coordinate generator Powered by an Apache webserver

Frank Oellien

last modified: 12.09.2004 11:17 PM