Molecular BioSystems

Research at the interface of chemistry and biology: chemical biology, -omics sciences and systems biology.

Paper

Quantum clustering and network analysis of MD simulation trajectories to probe the conformational ensembles of proteinligand interactions

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Corresponding authors
a
Molecular Biophysics Unit, Indian Institute of Science, Bangalore-560012, India
E-mail: sv@mbu.iisc.ernet.in
Mol. BioSyst., 2011,7, 2320-2330

DOI: 10.1039/C1MB05038A
Received 31 Jan 2011, Accepted 03 May 2011
First published online 27 May 2011
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