Chemistry: Software: Cheminformatics

the entire directory only this category

Home : Chemistry : Software : Cheminformatics
LINKS:
3D structure generator CORINA http://www2.ccc.uni-erlangen.de/software/corina/ 3D coordinate generator for organic molecules; interactive Java applet provides interactive conversion Advanced Pharma Algorithms http://ap-algorithms.com/ PC Software for QSAR and lead optimization. QSAR Builder, ADME/Tox Screens, QSAR Stats, and Algorithm Builder. Bioreason http://www.bioreason.com Desktop software and services for screening data analysis, hit to lead finding, scaffolds identification, SAR development and lead optimization. Downloadable trial ClassPharmer Suite available upon request. Cheminformatics.org http://www.cheminformatics.org Links to cheminformatics programs and QSAR datasets. Most programs are free, at least to academics. ChemTK http://www.sageinformatics.com Tools for visualization, clustering, querying, QSAR, descriptors, and similarity analyses of chemical information. Free version available. A chemistry toolkit for Windows. ID Business Solutions http://www.idbs.com/ Integrated framework for discovery data, from initial data capture to results analysis and reporting, to long-term data management. Molinspiration Cheminformatics http://www.molinspiration.com/ Web-enabled software for large-scale calculation of molecular properties and database searches. Free online molecular descriptor calculations.

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