3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships
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Published By Kluwer Academic Publishers

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EVA: A Novel Theoretical Descriptor for QSAR Studies

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_20 ◽

2005 ◽

pp. 381-398 ◽

Cited By ~ 1

Author(s):

Trevor W. Heritage ◽

Allan M. Ferguson ◽

David B. Turner ◽

Peter Willett

Keyword(s):

Qsar Studies

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Comparative Binding Energy Analysis

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_2 ◽

2005 ◽

pp. 19-34 ◽

Cited By ~ 2

Author(s):

Rebecca C. Wade ◽

Angel R. Qrtiz ◽

Federico Gago

Keyword(s):

Binding Energy ◽

Energy Analysis ◽

Comparative Binding ◽

Binding Energy Analysis

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Receptor-Based Prediction of Binding Affinities

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_3 ◽

2005 ◽

pp. 35-61 ◽

Cited By ~ 4

Author(s):

Tudor I. Oprea ◽

Garland R. Marshall

Keyword(s):

Binding Affinities

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Bioisosterism and Molecular Diversity

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_12 ◽

2005 ◽

pp. 213-224

Author(s):

Robert D. Clark ◽

Allan M. Ferguson ◽

Richard D. Cramer

Keyword(s):

Molecular Diversity

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Rapid Estimation of Relative Binding Affinities of Enzyme Inhibitors

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_5 ◽

2005 ◽

pp. 85-98 ◽

Cited By ~ 1

Author(s):

M. Rami Reddy ◽

Velarkad N. Viswanadhan ◽

M. D. Erion

Keyword(s):

Enzyme Inhibitors ◽

Binding Affinities ◽

Rapid Estimation ◽

Relative Binding

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Pharmacophore Modelling: Methods,Experimental Verification and Applications

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_14 ◽

2005 ◽

pp. 253-271 ◽

Cited By ~ 1

Author(s):

Arup K. Ghose ◽

John J. Wendoloski

Keyword(s):

Experimental Verification ◽

Pharmacophore Modelling ◽

Modelling Methods

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Progress in Force-Field Calculations of Molecular Interaction Fields and Intermolecular Interactions

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_1 ◽

2005 ◽

pp. 3-17 ◽

Cited By ~ 1

Author(s):

Tommy Liljefors

Keyword(s):

Force Field ◽

Intermolecular Interactions ◽

Molecular Interaction ◽

Force Field Calculations ◽

Molecular Interaction Fields

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Density-Functional Theory and Molecular Dynamics: A New Perspective for Simulations of Biological Systems

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_9 ◽

2005 ◽

pp. 161-167

Author(s):

Wanda Andreoni

Keyword(s):

Molecular Dynamics ◽

Density Functional Theory ◽

Density Functional ◽

Biological Systems ◽

Functional Theory ◽

New Perspective

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A Priori Prediction of Ligand Affinity by Energy Minimization

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_4 ◽

2005 ◽

pp. 63-84 ◽

Cited By ~ 1

Author(s):

M. Katharine Holloway

Keyword(s):

Energy Minimization ◽

A Priori ◽

Ligand Affinity

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New 3D Molecular Descriptors: The WHIM theory and QSAR Applications

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships ◽

10.1007/0-306-46857-3_19 ◽

2005 ◽

pp. 355-380 ◽

Cited By ~ 10

Author(s):

Roberto Todeschini ◽

Paola Gramatica

Keyword(s):

Molecular Descriptors

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3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity RelationshipsLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By Kluwer Academic Publishers

EVA: A Novel Theoretical Descriptor for QSAR Studies

Comparative Binding Energy Analysis

Receptor-Based Prediction of Binding Affinities

Bioisosterism and Molecular Diversity

Rapid Estimation of Relative Binding Affinities of Enzyme Inhibitors

Pharmacophore Modelling: Methods,Experimental Verification and Applications

Progress in Force-Field Calculations of Molecular Interaction Fields and Intermolecular Interactions

Density-Functional Theory and Molecular Dynamics: A New Perspective for Simulations of Biological Systems

A Priori Prediction of Ligand Affinity by Energy Minimization

New 3D Molecular Descriptors: The WHIM theory and QSAR Applications

3D QSAR in Drug Design - Three-Dimensional Quantitative Structure Activity Relationships
Latest Publications