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Computational chemistry
Results: 1931

#	Item
301	1934 J. Phys. Chem. A 2009, 113, 1934–1945 Computational Modeling of Oxygen Isotope Effects on Metal-Mediated O2 Activation at Varying Temperatures† Add to Reading List Source URL: pages.jh.edu Language: English - Date: 2012-09-14 16:24:04 Chemical elements Nonmetals Isotopes Kinetic isotope effect Chemical equilibrium Isotopic labeling Oxygen Transition state theory Temperature Chemistry Chemical kinetics Physical chemistry
302	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
303	This article appeared in a journal published by Elsevier. The attached copy is furnished to the author for internal non-commercial research and education use, including for instruction at the authors institution and shar Add to Reading List Source URL: www.claudiocazorla.com Language: English - Date: 2010-08-28 12:01:37 Nitrogen metabolism Computational chemistry Surface chemistry Graphene Hydroxyproline Collagen Amino acid Adsorption Carbon nanotube Chemistry Emerging technologies Nanomaterials
304	How water molecules dance to activate proteins Add to Reading List Source URL: phys.org Language: English - Date: 2015-05-31 18:06:06 Computational chemistry Molecular dynamics Protein Protein folding Hydrogen bond Chemistry Biology Molecular modelling
305	Goldschmidt 2000 September 3rd–8th, 2000 Oxford, UK. Journal of Conference Abstracts Volume 5(2), 1071 Add to Reading List Source URL: www.the-conference.com Language: English - Date: 2009-11-05 06:05:05 Computational chemistry Molecular modelling Thermodynamic properties Equation of state Thermodynamics Water vapor Properties of water Vapor pressure Hydrogen Chemistry Chemical engineering Intermolecular forces
306	Research Journal of Recent Sciences _________________________________________________ ISSNVol. 2(ISC-2012), Res. J. Recent. Sci. Role of Proteus mirabilis in Caffeine Degradation – A Preliminary Add to Reading List Source URL: www.isca.in Language: English - Date: 2013-10-04 03:56:41 Protein methods Science Protein structure Computational phylogenetics Caffeine Protein secondary structure Homology modeling Threading Decaffeination Bioinformatics Biology Chemistry
307	13321_2015_58_Article 1..9 Add to Reading List Source URL: www.jcheminf.com Language: English Statistics Pharmacology Medicinal chemistry Drug discovery Cheminformatics Quantitative structure–activity relationship ADAPA Pic50 Scientific modelling Science Chemistry Computational chemistry
308	Schwöbel et al. Journal of Cheminformatics 2012, 4(Suppl 1):O8 http://www.jcheminf.com/content/4/S1/O8 ORAL PRESENTATION Open Access Add to Reading List Source URL: www.jcheminf.com Language: English Cheminformatics Medicinal chemistry Pharmacology Quantitative structure–activity relationship Reactivity Molecule Chemical property Chemistry Science Computational chemistry
309	Van Westen et al. Journal of Cheminformatics 2010, 2(Suppl 1):O3 http://www.jcheminf.com/content/2/S1/O3 ORAL PRESENTATION Open Access Add to Reading List Source URL: www.jcheminf.com Language: English Chemistry Computational chemistry Medicinal chemistry Cheminformatics Pharmaceutical industry Quantitative structure–activity relationship Drug discovery Chemogenomics Pic50 Pharmaceutical sciences Science Pharmacology
310	Kramer and Liedl Journal of Cheminformatics 2014, 6(Suppl 1):O6 http://www.jcheminf.com/content/6/S1/O6 ORAL PRESENTATION Open Access Add to Reading List Source URL: www.jcheminf.com Language: English Cheminformatics Computational chemistry Pharmaceutical sciences Drug discovery Quantitative structure–activity relationship Chemical similarity Journal of Medicinal Chemistry ADME Matrix metalloproteinase Chemistry Science Medicinal chemistry

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