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May 4, 2016Journal of Chemical Theory and Computation

Prediction of Protein–Ligand Binding Poses via a Combination of Induced Fit Docking and Metadynamics Simulations

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Authors

ACAnthony J. ClarkPTPratyush TiwaryKBKen Borrelli

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Clark et al. (2016) studied this question.

synapsesocial.com/papers/6a02ff10bc3ffe278e653d56https://doi.org/10.1021/acs.jctc.6b00201
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