Cheminformatics

Results: 1164



#Item
171Cheminformatics / Toxicology / CLP Regulation / European Union / IUCLID / Registration /  Evaluation /  Authorisation and Restriction of Chemicals / Dangerous Substances Directive / European Commission number / Globally Harmonized System of Classification and Labelling of Chemicals / Safety / Chemistry / Occupational safety and health

EU risk assessment report

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Source URL: echa.europa.eu

Language: English
172Chemical nomenclature / Identifiers / Computational chemistry / Encodings / International Chemical Identifier / InChI Trust / Chemical database / Simplified molecular-input line-entry specification / ChemSpider / Chemistry / Science / Cheminformatics

Openness as infrastructure

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Source URL: www.jcheminf.com

Language: English
173Chemical patent / Cheminformatics / Patent / Chemical nomenclature / Law / Science / Patent law / Computational chemistry

Sayle et al. Journal of Cheminformatics 2011, 3(Suppl 1):O16 http://www.jcheminf.com/content/3/S1/O16 ORAL PRESENTATION Open Access

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Source URL: www.jcheminf.com

Language: English
174Pharmacology / Structure–activity relationship / Journal of Medicinal Chemistry / Cheminformatics / Drug discovery / Matrix metalloproteinase / Pharmaceutical sciences / Medicinal chemistry / Chemistry

Wassermann Journal of Cheminformatics 2014, 6(Suppl 1):O14 http://www.jcheminf.com/content/6/S1/O14 ORAL PRESENTATION Open Access

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Source URL: www.jcheminf.com

Language: English
175Drug discovery / Ring theory / Algebraic structures / Ring / Cycloalkane / Science / Mathematics / Computational chemistry / Cheminformatics / Chemistry

Rarey et al. Journal of Cheminformatics 2013, 5(Suppl 1):O8 http://www.jcheminf.com/content/5/S1/O8 ORAL PRESENTATION Open Access

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Source URL: www.jcheminf.com

Language: English
176Cheminformatics / Drug discovery / Materials science / Supramolecular chemistry / Bioinformatics / Dynamic combinatorial chemistry / Combinatorial chemistry / Virtual screening / Molecular recognition / Chemistry / Pharmaceutical sciences / Science

The relationship between difference and ratio and a proposal: Equivalence of temperature and time, and the first spontaneous symmetry breaking

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Source URL: www.jsystchem.com

Language: English
177Medicinal chemistry / Computational chemistry / Cheminformatics / Pharmacology / Drug design / Docking / Virtual screening / Ligand / Quantitative structure–activity relationship / Chemistry / Science / Drug discovery

Klebe Journal of Cheminformatics 2011, 3(Suppl 1):O18 http://www.jcheminf.com/content/3/S1/O18 ORAL PRESENTATION Open Access

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Source URL: www.jcheminf.com

Language: English
178Physics / Equilibrium chemistry / Dortmund Data Bank / Dortmund University of Technology / Jürgen Gmehling / UNIFAC / Process simulation / Group contribution method / Cheminformatics / Thermodynamics / Chemistry / Chemical engineering

Gmehling Journal of Cheminformatics 2011, 3(Suppl 1):O15 http://www.jcheminf.com/content/3/S1/O15 ORAL PRESENTATION Open Access

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Source URL: www.jcheminf.com

Language: English
179Chemical education / Gesellschaft Deutscher Chemiker / Science and technology in Germany / Computational chemistry / Cheminformatics / Johann Friedrich Gmelin / Chemical Computing Group / Science / Chemistry / Biology

Oellien et al. Journal of Cheminformatics 2011, 3(Suppl 1):I1 http://www.jcheminf.com/content/3/S1/I1 INTRODUCTION Open Access

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Source URL: www.jcheminf.com

Language: English
180Computational chemistry / Drug discovery / Chemistry Central / Computational science / Science / Cheminformatics / Chemistry

Kostka Journal of Cheminformatics 2010, 2(Suppl 1):O13 http://www.jcheminf.com/content/2/S1/O13 ORAL PRESENTATION Open Access

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Source URL: www.jcheminf.com

Language: English
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