Computational chemistry

Results: 1931



#Item
811Materials science / Computational chemistry / Molecular modelling / Adsorption / Colloidal chemistry / Molecule / Docking / Physisorption / Chemistry / Science / Surface chemistry

Introductions to Patents Patent No[removed]Program and Related Device Based on Conductor Model for Analyzing Molecules and Other Particles Adsorbed on Metal

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Source URL: www.nict.go.jp

Language: English - Date: 2014-01-20 00:28:38
812Medicinal chemistry / Molecular modelling / Protein structure / Cheminformatics / Quantitative structure–activity relationship / Docking / Accessible surface area / Molecule / Chemistry / Computational chemistry / Science

Chemical and physical property prediction from electronic properties of molecular surfaces • Cytochrome P450 drug metabolism prediction* • Ligand docking - improved accuracy** • 3D QSAR & QSPR - novel electronic de

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Source URL: cacheresearch.com

Language: English - Date: 2010-03-17 17:49:28
813Computational chemistry / Medicinal chemistry / Bioinformatics / Molecular graphics / Visualization / Computer-aided design / Drug design / Docking / Chemical bond / Science / Chemistry / Drug discovery

q&more English Issue[removed]Highest Quality in the Laboratory and in the Process

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Source URL: cacheresearch.com

Language: English - Date: 2012-08-21 07:26:34
814Computational chemistry / Censuses / Demography / Genealogy / Survey methodology / Perturbation theory / Perturbation / Statistics / Science / Physics

Geographical Perturbation for Disclosure Control Caroline Young, University of Southampton [removed] Professor Chris Skinner, Professor David Martin Innovative Methodologies for Censuses in the New Millennium

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Source URL: www.s3ri.soton.ac.uk

Language: English - Date: 2007-09-08 12:35:27
815Named-entity recognition / Chemical database / Dictionary / Noun / Formal grammar / Word-sense disambiguation / Entity / DICT / Chemistry / Linguistics / Science / Computational linguistics

Lowe and Sayle Journal of Cheminformatics 2015, 7(Suppl 1):S5 http://www.jcheminf.com/content/7/S1/S5 RESEARCH Open Access

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Source URL: www.jcheminf.com

Language: English
816Computational neuroscience / Organic chemistry / Neural networks / Computational statistics / Photosynthesis / Artificial neural network / Soil / Carbon / Organic matter / Chemistry / Biology / Science

An Application into Using Artificial Intelligence for Estimating Organic Carbon

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Source URL: www.mssanz.org.au

Language: English - Date: 2013-01-15 18:53:26
817Medicinal chemistry / Clinical research / Drug discovery / Metabolism / Arieh Warshel / Drug design / Paracetamol / Enzyme / Aspirin / Chemistry / Pharmaceutical sciences / Pharmacology

review December 2013 YOUR FREE CHEMISTRY REVIEW UPDATE computational

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Source URL: www.hoddereducation.co.uk

Language: English - Date: 2015-03-05 09:34:00
818Drug discovery / Cheminformatics / Molecular modelling / Bioinformatics / Docking / Cdb / AS/400 Control Language / Chemical database / Extract /  transform /  load / Chemistry / Computational chemistry / Science

Chapter 7 The Virtual Laboratory: Enabling Drug Design on the Grid This chapter presents the design and development of a virtual laboratory environment that enables molecular modelling for drug design on geographically

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Source URL: www.buyya.com

Language: English - Date: 2004-02-17 00:02:08
819Science / Medicinal chemistry / Pharmacology / Quantitative structure–activity relationship / Organisation for Economic Co-operation and Development / Database / Cheminformatics / Computational chemistry / Chemistry

OECD QSAR Toolbox v.3.2 Illustrating functionalities of Query tool Outlook •

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Source URL: oasis-lmc.org

Language: English - Date: 2014-03-25 11:47:17
820Computational chemistry / Simulation / Science / Materials science / Electronic engineering / Ethology / Engineering / Ethics / Philosophy of science

Microsoft Word - RAP_Advertise_Final.docx

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Source URL: yangtze.hku.hk

Language: English - Date: 2013-04-22 08:21:45
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