Exploring the free-energy landscape of carbohydrate–protein complexes: development and validation of scoring functions considering the binding-site topology

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Editorial: Structural and Computational Glycobiology - Immunity and Infection.

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Q41075810-EC4E04DB-CDB9-41D9-BE25-A306F756E003

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Exploring the free-energy landscape of carbohydrate–protein complexes: development and validation of scoring functions considering the binding-site topology

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http://www.wikidata.org/entity/Q56989244

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article

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wetenschappelijk artikel

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наукова стаття, опублікована у вересні 2014

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Exploring the free-energy land ...... ring the binding-site topology

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Exploring the free-energy land ...... ring the binding-site topology

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Exploring the free-energy land ...... ring the binding-site topology

@en

Exploring the free-energy land ...... ring the binding-site topology

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Exploring the free-energy land ...... ring the binding-site topology

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Exploring the free-energy land ...... ring the binding-site topology

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P1476

Exploring the free-energy land ...... ring the binding-site topology

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P2093

Adam Zalewski

http://www.w3.org/2001/XMLSchema#string

Angelo Vedani

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Sameh Eid

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BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities

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The xenograft antigen bound to Griffonia simplicifolia lectin 1-B(4). X-ray crystal structure of the complex and molecular dynamics characterization of the binding site.

Crystallographic and computational studies on 4-phenyl-N-(beta-D-glucopyranosyl)-1H-1,2,3-triazole-1-acetamide, an inhibitor of glycogen phosphorylase: comparison with alpha-D-glucose, N-acetyl-beta-D-glucopyranosylamine and N-benzoyl-N'-beta-D-gluc

Influence of glycosidic linkage on the nature of carbohydrate binding in beta-prism I fold lectins: an X-ray and molecular dynamics investigation on banana lectin-carbohydrate complexes

Molecular simulations of carbohydrates and protein-carbohydrate interactions: motivation, issues and prospects

Comparison of multiple Amber force fields and development of improved protein backbone parameters

The Poisson-Boltzmann equation for biomolecular electrostatics: a tool for structural biology

Approaches to the description and prediction of the binding affinity of small-molecule ligands to macromolecular receptors

Glide: a new approach for rapid, accurate docking and scoring. 1. Method and assessment of docking accuracy

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s10822-014-9794-3

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1191-1204

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scholarly article

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10.1007/S10822-014-9794-3

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P433

http://www.w3.org/2001/XMLSchema#string

P478

http://www.w3.org/2001/XMLSchema#string

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Noureldin Saleh

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2014-09-10T00:00:00Z

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P698

25205292

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Exploring the free-energy landscape of carbohydrate–protein complexes: development and validation of scoring functions considering the binding-site topology

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P2860

P2860

Exploring the free-energy landscape of carbohydrate–protein complexes: development and validation of scoring functions considering the binding-site topology

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P1433

P1476

P2093

P2860

P2888

P304

P31

P356

P433

P478

P50

P577

P698

P356

P1433

P1476

P2093

P2860

P2888

P304

P31

P356

P433

P478

P50

P577

P698