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Prediction of binding sites in receptor-ligand complexes with the Gaussian Network Model

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Haliloğlu, Türkan
Seyrek, Emek

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Abstract

Residues at the binding sites of the ligand and receptor of several enzyme-inhibitor and antibody-antigen complexes are predicted from the slowest (for the ligand) and fastest (for the receptor) modes of motion by the Gaussian Network Model applied to unbound molecules.

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American Physical Society (APS)

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Multidisciplinary physics

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Physical Review Letters

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10.1103/PhysRevLett.100.228102

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