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Quantitative structure–activity relationship
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1	Identifying Structure-Activity Cliffs in a Salmonella QSAR Model for Predicting the Potential Mutagenicity of Genotoxic Drug Impurities and Other Organic Molecules P46 Kevin P. Cross1, R. Daniel Benz2, Lidiya Stavitskay Add to Reading List Source URL: www.leadscope.com Language: English - Date: 2015-11-13 06:28:16 Medicinal chemistry Cheminformatics Drug discovery Computational chemistry Quantitative structureactivity relationship Clinical research Structureactivity relationship Chemical substance Matched molecular pair analysis
2	Mapping the Human Toxome by Systems Toxicology Using ED as Proof of Concept Thomas Hartung Doerenkamp-Zbinden Professor and Chair for Evidence-based Toxicology, EHS Director, Center for Alternatives to Animal Testing (CA Add to Reading List Source URL: www.tera.org Language: English - Date: 2014-02-13 21:19:26 Toxicology Alternatives to animal testing Endocrine system Chemistry Quantitative structure–activity relationship Science Medicine Endocrinology Pharmacology Endocrine disruptor
3	Data Mining in Bioinformatics Day 8: Graph Mining for Chemoinformatics and Drug Discovery Chloé-Agathe Azencott Machine Learning & Computational Biology Research Group MPIs Tübingen Add to Reading List Source URL: agbs.kyb.tuebingen.mpg.de Language: English - Date: 2012-02-14 08:07:29 Pharmacology Cheminformatics Drug discovery Medicinal chemistry Computational chemistry Quantitative structure–activity relationship Molecular descriptor Drug design Pharmaceutical sciences Science Chemistry
4	QSAR Applicability Domain (AD) assessment Substance: CASisobutyl dihydrogen phosphate) According to QSAR Applicability Domain (AD) assessment the fully documented and REACH compliant QSAR reports are availabl Add to Reading List Source URL: reachqsar.com Language: English - Date: 2011-10-08 16:02:23 Pharmacology Chemistry Science Health Acute toxicity Quantitative structure–activity relationship Applicability Domain Toxicity Tartu Toxicology Medicinal chemistry Cheminformatics
5	Final Report Effects of Molecular and Environmental Properties on Removal of Pharmaceuticals, Endocrine Disruptors and Disinfection Byproducts by Polyamide RO Membranes Submitted by: Orange County Water District Add to Reading List Source URL: www.ocwd.com Language: English - Date: 2013-10-10 17:01:16 Filters Medicinal chemistry Water treatment Water technology Reverse osmosis Quantitative structure–activity relationship Partition coefficient Disinfectant Thin-film composite membrane Chemistry Membrane technology Chemical engineering
6	Openness as infrastructure Add to Reading List Source URL: www.jcheminf.com Language: English Scientific method Hypothesis testing Philosophy of science Hypothesis Quantitative structure–activity relationship Statistics Creativity Statistical power Machine learning Science Information Knowledge
7	TESTIMONY OF PHYSICIANS COMMITTEE FOR RESPONSIBLE MEDICINE AND PEOPLE FOR THE ETHICAL TREATMENT OF ANIMALS AND THE HUMANE SOCIETY OF THE UNITED STATES, HUMANE SOCIETY INTERNATIONAL, Add to Reading List Source URL: www.pcrm.org Language: English - Date: 2010-10-31 13:59:32 Toxicology Animal rights Environmental law Cheminformatics 94th United States Congress Toxic Substances Control Act Registration Evaluation Authorisation and Restriction of Chemicals Regulation of chemicals Quantitative structure–activity relationship Science Chemistry Health
8	Research OpportunitiesProf John Blacker Prof. John Blacker ; Dr Bao Nguyen; Dr Natalie Fey; Dr Stefan Auer This project is co-sponsored by AstraZeneca and the PhD position is currently avai Add to Reading List Source URL: www.chem.leeds.ac.uk Language: English - Date: 2015-04-14 08:25:15 Solubility Medicinal chemistry Cheminformatics Computational chemistry Chemical substance Quantitative structure–activity relationship Chemistry Science Solutions
9	Descriptor-free molecular discovery in large libraries by adaptive substituent reordering Add to Reading List Source URL: www.princeton.edu Language: English - Date: 2010-10-27 20:48:54 Cheminformatics Medicinal chemistry Pharmacology Organic chemistry Quantitative structure–activity relationship Substituent Combinatorial chemistry Drug discovery Chemistry Pharmaceutical sciences Science
10	PDF Document Add to Reading List Source URL: www.cacheresearch.com Language: English - Date: 2011-09-24 15:15:40 Animal rights Pharmacology Cheminformatics Computational chemistry Medicinal chemistry Quantitative structure–activity relationship In silico Animal testing ADAPA Science Scientific method Biology