Computational chemistry

Results: 1931



#Item
941Theoretical chemistry / Knowledge / Chemist / Computational chemistry / Philosophy of chemistry / Reductionism / Outline of chemistry / Metaphysics / Quantum chemistry / Science / Philosophy of science / Chemistry

Editorial: Models in Chemistry, Part 1

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Source URL: hyle.org

Language: English - Date: 2013-03-20 19:42:26
942Science / Computational chemistry / Molecular dynamics / Uncertainty quantification / Scientific modelling / Simulation / Nuclear force / Mathematical sciences / Operations research / Physics / Molecular modelling

Microsoft PowerPoint - OECD.NEA.Talk

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Source URL: www.oecd-nea.org

Language: English - Date: 2008-06-23 23:02:50
943Quantum chemistry / Computational chemistry / Theoretical chemistry / Nuclear reaction / Differential equation / Wave function / Equations / Hamiltonian / Schrödinger equation / Physics / Quantum mechanics / Chemistry

Coupled Reaction Channels Calculations in Nuclear Physics Ian J. Thompson Department of Engineering Mathematics, Bristol University, Bristol, BS8 1TR, UK Address after 1st August 1988:

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Source URL: www.fresco.org.uk

Language: English - Date: 2007-07-30 13:04:54
944Theoretical chemistry / Atomic physics / Computational chemistry / Molecular orbital / Chemical bond / Molecular symmetry / Orbital hybridisation / Sigma bond / Linear combination of atomic orbitals / Chemistry / Chemical bonding / Quantum chemistry

Symmetry and Complexity: Fundamental Concepts of Research in Chemistry

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Source URL: hyle.org

Language: English - Date: 2013-03-20 15:22:17
945Pharmacology / Medicinal chemistry / Computational chemistry / Quantitative structure–activity relationship / Toxicology / Molecular descriptor / Ecotoxicology / Applicability Domain / Chemical property / Chemistry / Cheminformatics / Science

Overview of activities within WP 3 Development and validation of QSAR models Paola Gramatica WP3 leader QSAR Research Unit in Environmental Chemistry and Ecotoxicology DBSF -University of Insubria, Varese - Italy

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Source URL: www.cadaster.eu

Language: English - Date: 2012-05-31 11:35:49
946Cheminformatics / Medicinal chemistry / Knowledge / Computational chemistry / Quantitative structure–activity relationship / Applicability Domain / Risk assessment / Uncertainty / Science / Chemistry / Pharmacology

CADASTER CAse studies on the Development and Application of in-Silico Techniques for Environmental hazard and Risk assessment Grant agreement no.: [removed]Collaborative Project Sub-Priority ENV2007[removed]: In-silico tech

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Source URL: www.cadaster.eu

Language: English - Date: 2013-02-12 13:19:05
947Pharmacology / Chemistry / Medicinal chemistry / Quantitative structure–activity relationship / Toxicology / Validation / Ecotoxicology / Research / Science / Cheminformatics / Computational chemistry

CADASTER CAse studies on the Development and Application of in-Silico Techniques for Environmental hazard and Risk assessment Grant agreement no.: [removed]Collaborative Project Sub-Priority ENV2007[removed]: In-silico tech

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Source URL: www.cadaster.eu

Language: English - Date: 2012-05-31 11:35:10
948Pharmacology / Medicinal chemistry / Ethology / Computational chemistry / Quantitative structure–activity relationship / Mathematical chemistry / Applicability Domain / Prediction / Economic model / Cheminformatics / Science / Chemistry

CADASTER CAse studies on the Development and Application of in-Silico Techniques for Environmental hazard and Risk assessment Grant agreement no.: [removed]Collaborative project Sub-Priority ENV2007[removed]: In-silico tech

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Source URL: www.cadaster.eu

Language: English - Date: 2012-07-02 08:10:06
949Pharmacology / Cheminformatics / Computational chemistry / Quantitative structure–activity relationship / Toxicology / Ecotoxicology / Partition coefficient / Structure–activity relationship / Applicability Domain / Medicinal chemistry / Chemistry / Science

CADASTER CAse studies on the Development and Application of in-Silico Techniques for Environmental hazard and Risk assessment Grant agreement no.: [removed]Collaborative Project Sub-Priority ENV2007[removed]: In-silico tech

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Source URL: www.cadaster.eu

Language: English - Date: 2012-05-31 11:35:10
950Science / Medicinal chemistry / Pharmacology / Quantitative structure–activity relationship / Database / Molecular descriptor / Cheminformatics / Chemistry / Computational chemistry

CADASTER CAse studies on the Development and Application of in-Silico Techniques for Environmental hazard and Risk assessment Grant agreement no.: [removed]Collaborative Project Sub-Priority ENV2007[removed]: In-silico tech

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Source URL: www.cadaster.eu

Language: English - Date: 2012-05-31 11:35:10
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