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Prediction of ligand-binding sites of proteins by molecular docking calculation for a random ligand library

A new approach to predicting the ligand-binding sites of proteins was developed, using protein-ligand docking computation. In this method, many compounds in a random library are docked onto the whole protein surface. We assumed that the true ligand-binding site would exhibit stronger affinity to the...

Disgrifiad llawn

Wedi'i Gadw mewn:
Manylion Llyfryddiaeth
Prif Awduron: Fukunishi, Yoshifumi, Nakamura, Haruki
Fformat: Artigo
Iaith:Inglês
Cyhoeddwyd: Wiley Subscription Services, Inc., A Wiley Company 2011
Pynciau:
Mynediad Ar-lein:https://ncbi.nlm.nih.gov/pmc/articles/PMC3047065/
https://ncbi.nlm.nih.gov/pubmed/21064162
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/pro.540
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