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Cheminformatics
Directory > Science > Chemistry > Software > Cheminformatics

Web Sitesi

Topological descriptors
Descriptor is a free VisualBasic program for the calculation of graph-theoretic indices.
http://www.geocities.com/jonarg/index.htm
Reviews Rating: Not yet Rated Whois Check

Bioreason
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.
http://www.bioreason.com
Reviews Rating: Not yet Rated Whois Check

JOELib
Java based computational chemistry package which supports file conversion, SMARTS substructure
search, QSAR descriptor calculation and process/filter methods for molecular data sets.
http://www-ra.informatik.uni-tuebingen.de/software/joelib/index.html
Reviews Rating: Not yet Rated Whois Check

ID Business Solutions
Integrated framework for discovery data, from initial data capture to results analysis and
reporting, to long-term data management.
http://www.id-bs.com/
Reviews Rating: Not yet Rated Whois Check

Advanced Pharma Algorithms
PC Software for QSAR and lead optimization. QSAR Builder, ADME/Tox Screens, QSAR Stats, and
Algorithm Builder.
http://ap-algorithms.com/
Reviews Rating: Not yet Rated Whois Check

Molinspiration Cheminformatics
Web-enabled software for large-scale calculation of molecular properties and database searches.
Free online molecular descriptor calculations.
http://www.molinspiration.com/
Reviews Rating: Not yet Rated Whois Check

 


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