(Q30843844)

27 June 2017

title

Statistical relationships among docking scores for different protein binding sites (English)

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27 June 2017

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Koehler RT

1

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27 June 2017

Villar HO

series ordinal

2

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27 June 2017

publication date

1 January 2000

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Journal of Computer - Aided Molecular Design

27 June 2017

published in

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27 June 2017

volume

14

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27 June 2017

issue

1

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27 June 2017

page(s)

23-37

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Structure-based strategies for drug design and discovery

27 June 2017

cites work

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12 December 2020

Solvent-accessible surfaces of proteins and nucleic acids

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12 December 2020

Immunological origins of binding and catalysis in a Diels-Alderase antibody

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12 December 2020

Crystal structures of Escherichia coli and Lactobacillus casei dihydrofolate reductase refined at 1.7 A resolution. II. Environment of bound NADPH and implications for catalysis.

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12 December 2020

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12 December 2020

Flexible ligand docking using conformational ensembles

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12 December 2020

X-ray crystallographic analysis of inhibition of endothiapepsin by cyclohexyl renin inhibitors

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12 December 2020

Refined crystal structure of type III chloramphenicol acetyltransferase at 1.75 A resolution

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12 December 2020

A geometric approach to macromolecule-ligand interactions

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12 December 2020

Computational methods for biomolecular docking.

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12 December 2020

Using shape complementarity as an initial screen in designing ligands for a receptor binding site of known three-dimensional structure.

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12 December 2020

Structure, multiple site binding, and segmental accommodation in thymidylate synthase on binding dUMP and an anti-folate

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12 December 2020

Protein recognition of adenylate: an example of a fuzzy recognition template

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12 December 2020

The interdependence of protein surface topography and bound water molecules revealed by surface accessibility and fractal density measures

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12 December 2020

Crystallographic analysis at 3.0-A resolution of the binding to human thrombin of four active site-directed inhibitors

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12 December 2020

Evaluating docked complexes with the HINT exponential function and empirical atomic hydrophobicities.

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12 December 2020

Bioactive diversity and screening library selection via affinity fingerprinting

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12 December 2020

Structure-based discovery of inhibitors of thymidylate synthase

1 reference

12 December 2020

Predicting ligand binding to proteins by affinity fingerprinting

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12 December 2020

Orientational sampling and rigid-body minimization in molecular docking

1 reference

12 December 2020

Molecular basis for binding promiscuity of antagonist drugs

1 reference

12 December 2020

Atomic Structure of Acetylcholinesterase from Torpedo californica : A Prototypic Acetylcholine-Binding Protein

1 reference

12 December 2020

Structure of papain refined at 1.65 A resolution

1 reference

12 December 2020

Molecular docking towards drug discovery

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12 December 2020

Identifiers

DOI

10.1023/A:1008136613726

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journals/jcamd/KoehlerV00

27 June 2017

DBLP publication ID

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DBLP Dataset 2021-01-02

Dimensions Publication ID

28 January 2021

1053168326

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