Anatomy of protein pockets and cavities: measurement of binding site geometry and implications for ligand design.

Identification and size characterization of surface pockets and occluded cavities are initial steps in protein structure-based ligand design. A new program, CAST, for automatically locating and measuring protein pockets and cavities, is based on precise computational geometry methods, including alph...

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Bibliographic Details
Main Authors: Liang, J., Edelsbrunner, H., Woodward, C.
Format: Artigo
Language:Inglês
Published: Cold Spring Harbor Laboratory Press 1998
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Research Article
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC2144175/
https://ncbi.nlm.nih.gov/pubmed/9761470
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