Crystallographic and Modeling Methods in Molecular Design
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Published By Springer New York

9781461279877, 9781461233749

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The Use of Molecular Dynamics and Free Energy Perturbation Approaches in Simulating the Properties of Macromolecules and Their Binding to Ligands

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_8 ◽

1990 ◽

pp. 114-122

Author(s):

Peter A. Kollman

Keyword(s):

Molecular Dynamics ◽

Free Energy ◽

Free Energy Perturbation ◽

Energy Perturbation

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The Potential Role of Solvation in the Dihydrofolate Reductase Species Selectivity of Trimethoprim

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_5 ◽

1990 ◽

pp. 56-79 ◽

Cited By ~ 4

Author(s):

Lee F. Kuyper

Keyword(s):

Dihydrofolate Reductase ◽

Potential Role ◽

Species Selectivity

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Design of Purine Nucleoside Phosphorylase Inhibitors Using X-Ray Crystallography

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_4 ◽

1990 ◽

pp. 43-55 ◽

Cited By ~ 4

Author(s):

Steven E. Ealick ◽

Y. S. Babu ◽

S. V. L. Narayana ◽

William J. Cook ◽

Charles E. Bugg

Keyword(s):

Purine Nucleoside Phosphorylase ◽

Purine Nucleoside ◽

Nucleoside Phosphorylase ◽

X Ray ◽

X Ray Crystallography

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Crystallographic and Pharmacological Studies of Antiviral Agents Against Human Rhinovirus

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_2 ◽

1990 ◽

pp. 9-28

Author(s):

Thomas J. Smith ◽

John Badger ◽

Marcia Kremer ◽

Marcos Oliveira ◽

Michael G. Rossmann ◽

...

Keyword(s):

Antiviral Agents ◽

Human Rhinovirus ◽

Pharmacological Studies

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Crystallography and Molecular Mechanics in Designing Drugs with Unknown Receptor Structure

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_11 ◽

1990 ◽

pp. 161-174 ◽

Cited By ~ 1

Author(s):

David J. Duchamp

Keyword(s):

Molecular Mechanics ◽

Receptor Structure

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Inhibitor Binding to Thymidylate Synthase Is Mediated by Different Structural Determinants than Those That Promote Tight Binding to Dihydrofolate Reductase

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_1 ◽

1990 ◽

pp. 1-8 ◽

Cited By ~ 1

Author(s):

David A. Matthews ◽

Cheryl A. Janson ◽

Ward W. Smith

Keyword(s):

Dihydrofolate Reductase ◽

Thymidylate Synthase ◽

Tight Binding ◽

Structural Determinants ◽

Inhibitor Binding

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The Cambridge Structural Database in Molecular Modeling: Systematic Conformational Analysis from Crystallographic Data

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_15 ◽

1990 ◽

pp. 211-228 ◽

Cited By ~ 1

Author(s):

Frank H. Allen ◽

Michael J. Doyle

Keyword(s):

Molecular Modeling ◽

Conformational Analysis ◽

Crystallographic Data ◽

Cambridge Structural Database ◽

Structural Database

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Molecular Recognition of DNA Minor Groove Binding Drugs

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_9 ◽

1990 ◽

pp. 123-150 ◽

Cited By ~ 14

Author(s):

Andrew H.-J. Wang ◽

Mai-Kun Teng

Keyword(s):

Molecular Recognition ◽

Minor Groove ◽

Minor Groove Binding ◽

Groove Binding ◽

Dna Minor Groove

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Aladdin: A Real Tool for Stucture-Based Drug Design

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_17 ◽

1990 ◽

pp. 254-263

Author(s):

Yvonne C. Martin

Keyword(s):

Drug Design

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Preferred Interaction Patterns from Crystallographic Databases

Crystallographic and Modeling Methods in Molecular Design ◽

10.1007/978-1-4612-3374-9_16 ◽

1990 ◽

pp. 229-253 ◽

Cited By ~ 1

Author(s):

R. Scott Rowland ◽

Frank H. Allen ◽

W. Michael Carson ◽

Charles E. Bugg

Keyword(s):

Interaction Patterns ◽

Crystallographic Databases

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Crystallographic and Modeling Methods in Molecular DesignLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By Springer New York

The Use of Molecular Dynamics and Free Energy Perturbation Approaches in Simulating the Properties of Macromolecules and Their Binding to Ligands

The Potential Role of Solvation in the Dihydrofolate Reductase Species Selectivity of Trimethoprim

Design of Purine Nucleoside Phosphorylase Inhibitors Using X-Ray Crystallography

Crystallographic and Pharmacological Studies of Antiviral Agents Against Human Rhinovirus

Crystallography and Molecular Mechanics in Designing Drugs with Unknown Receptor Structure

Inhibitor Binding to Thymidylate Synthase Is Mediated by Different Structural Determinants than Those That Promote Tight Binding to Dihydrofolate Reductase

The Cambridge Structural Database in Molecular Modeling: Systematic Conformational Analysis from Crystallographic Data

Molecular Recognition of DNA Minor Groove Binding Drugs

Aladdin: A Real Tool for Stucture-Based Drug Design

Preferred Interaction Patterns from Crystallographic Databases

Crystallographic and Modeling Methods in Molecular Design
Latest Publications