An In Silico Analysis of the Binding Modes and Binding Affinities of Small Molecule Modulators of PDZ-Peptide Interactions

Open Access

Peer-reviewed

Research Article

Garima Tiwari,

Affiliation Bioinformatics Center, National Institute of Immunology, Aruna Asaf Ali Marg, New Delhi, India
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Debasisa Mohanty

* E-mail: deb@nii.res.in

Affiliation Bioinformatics Center, National Institute of Immunology, Aruna Asaf Ali Marg, New Delhi, India
⨯

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Protein domains
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Binding analysis
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Free energy
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Biochemical simulations
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Small molecules
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Molecular dynamics
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Crystal structure
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Molecular structure
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