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Cheminformatics
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#	Item
221	Common Mistakes in Building QSAR Models Damjan Krstajić Research Centre for Cheminformatics Belgrade, Serbia www.rcc.org.rs Add to Reading List Source URL: cisrg.shef.ac.uk Language: English - Date: 2014-03-31 11:07:35 Model selection Estimation theory Econometrics Cross-validation Quantitative structure–activity relationship Linear regression Feature selection Tikhonov regularization Overfitting Statistics Machine learning Regression analysis
222	BioProfile - Extract Knowledge About Compound Cross Reactivities from Corporate Databases 6th Joint Sheffield Conference on Chemoinformatics 24th July, 2013 Dr. Bernd Beck Add to Reading List Source URL: cisrg.shef.ac.uk Language: English - Date: 2013-08-08 05:49:37 Data analysis Cheminformatics Chemistry Computational chemistry Data mining Cdb Database Drug discovery Data management Science
223	Schomburg et al. Journal of Cheminformatics 2011, 3(Suppl 1):O12 http://www.jcheminf.com/content/3/S1/O12 ORAL PRESENTATION Open Access Add to Reading List Source URL: www.jcheminf.com Language: English Knowledge Computational chemistry Computer graphics Scientific modeling Cheminformatics Diagram Visualization Depiction Unified Modeling Language Science Infographics Design
224	Microsoft Word - COCI Report to Bureau 2006.doc Add to Reading List Source URL: old.iupac.org Language: English - Date: 2006-10-27 12:55:58 Periodic table Cheminformatics Encodings Identifiers International Chemical Identifier Group Chemical nomenclature Chemistry Science
225	Leach Journal of Cheminformatics 2011, 3(Suppl 1):O5 http://www.jcheminf.com/content/3/S1/O5 ORAL PRESENTATION Open Access Add to Reading List Source URL: www.jcheminf.com Language: English Drug discovery Cheminformatics Medicinal chemistry Chemistry Central ADME Chemistry Science Computational chemistry
226	UNEP/POPS/POPRC.1/4 UNEP/OzL.Pro.11/Bur.1/ UNEP/POPS/POPRC.1/4 Add to Reading List Source URL: www.pops.int Language: English - Date: 2008-05-02 10:36:39 United Nations Development Group United Nations Environment Programme Stockholm Convention on Persistent Organic Pollutants Dangerous goods Toxicology Cheminformatics Safety Prevention Security
227	Microsoft Word - Registration timetable 2.doc Add to Reading List Source URL: www.alchemycompliance.com Language: English - Date: 2011-09-12 06:03:56 European Chemicals Agency Toxicology Cheminformatics
228	In 140 years Chemisches Zentralblatt published more than 900,000 pages: 700,000 contain ca. 2 million abstracts, 200,000 are indexes. Offering direct access to the information contained in the most important abstracts jo Add to Reading List Source URL: infochem.de Language: English Cheminformatics Bibliographic databases Zentralblatt MATH Science
229	REACH Only representative.qxp Add to Reading List Source URL: www.chemadvisor.com Language: English - Date: 2011-03-30 10:31:19 Toxicology Cheminformatics European Union Evaluation Health law Registration Evaluation Authorisation and Restriction of Chemicals IUCLID Material safety data sheet Health Safety Occupational safety and health
230	Openness as infrastructure Add to Reading List Source URL: www.biomedcentral.com Language: English Ruby OpenBabel Python SWIG Cheminformatics Application programming interface Object-oriented programming Cross-platform JavaScript Computing Software Scripting languages

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