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#	Item
721	Package ‘rcdk’ August 31, 2014 Version 3.3.0 Date 2014-08-30 Title rcdk - Interface to the CDK Libraries Maintainer Rajarshi Guha Add to Reading List Source URL: cran.r-project.org Language: English - Date: 2014-08-31 02:05:45 Cheminformatics Quantum chemistry Chemical nomenclature Mathematical chemistry Molecular descriptor Chemical bond Electron Molecule Chemical formula Chemistry Science Physics
722	Technology from Harrod’s Creek December 2003 Big Online Customers: Getting Restless, Aren’t They? The 2003 International Chemical Information Conference turned Nimes into a global center for high-value online informa Add to Reading List Source URL: www.arnoldit.com Language: English - Date: 2008-08-27 16:02:23 Pharmaceutical industry Pharmacology Pharmacy Chemical patent Cheminformatics Science Patent law Computational chemistry
723	Microsoft Word - 20 Appendix F SMILES Notation Tutorial.doc Add to Reading List Source URL: www.epa.gov Language: English - Date: 2012-09-13 15:55:32 Encodings Chemical nomenclature Simplified molecular-input line-entry specification Aromatic hydrocarbon Aromaticity Porphin Chemistry Science Cheminformatics
724	Microsoft Word - 06 ECOSAR.doc Add to Reading List Source URL: www.epa.gov Language: English - Date: 2012-09-13 15:55:31 Cheminformatics Computational chemistry Pharmacology Quantitative structure–activity relationship Toxicity Ethoxylation Partition coefficient Chemistry Medicinal chemistry Toxicology
725	Package ‘rcdklibs’ August 31, 2014 Version 1.5.8.4 Date 2014-08-30 Title rcdklib - CDK libraries packaged for R Maintainer Rajarshi Guha Add to Reading List Source URL: cran.r-project.org Language: English - Date: 2014-08-31 02:05:48 R Cheminformatics Bioinformatics Software CDK Curses
726	rcdk: Integrating the CDK with R Rajarshi Guha Miguel Rojas Cherto August 30, 2014 Contents Add to Reading List Source URL: cran.r-project.org Language: English - Date: 2014-08-31 02:05:45 Computational chemistry Chemical nomenclature Encodings Simplified molecular-input line-entry specification Molecular descriptor Molecule Chemical bond Molecular geometry Chemical file format Science Cheminformatics Chemistry
727	Carolina Center for Computational Toxicology Ivan Rusyn, Karen Yeatts, Shawn Gomez, Timothy Elston, Fred Wright, Alexander Tropsha[removed]The University of North Carolina at Chapel Hill Add to Reading List Source URL: www.epa.gov Language: English - Date: 2012-05-07 10:13:53 Pharmacology Cheminformatics Computational chemistry Genomics Toxicogenomics Quantitative structure–activity relationship Bioinformatics High-throughput screening Scientific modelling Science Knowledge Toxicology
728	DSSTox & Chemical Information Technologies in Support of Toxicity Prediction research Ann Richard1, Maritja Wolf2, Matthew Martin1, David Reif1, Richard Judson1 1U.S Add to Reading List Source URL: www.epa.gov Language: English - Date: 2012-05-07 10:13:42 Computational chemistry ChemSpider Simplified molecular-input line-entry specification Science Chemistry Cheminformatics
729	Microsoft PowerPoint - Validation of a Computerized Color Vision Test.pptx Add to Reading List Source URL: www.colorvisiontesting.com Language: English - Date: 2014-07-20 15:15:09 Bioinformatics Biostatistics Cheminformatics Sensitivity and specificity Color vision Color perception test Statistics Color Medical statistics
730	Microsoft Word - TOX21S_LogFile_22Mar2012.doc Add to Reading List Source URL: www.epa.gov Language: English - Date: 2012-04-11 12:05:50 Cheminformatics Chemical nomenclature Encodings Identifiers International Chemical Identifier United States Environmental Protection Agency Science Chemistry Computational chemistry

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