D3R Grand Challenge 3: blind prediction of protein-ligand poses and affinity rankings

Zied Gaieb, Conor D. Parks, Michael Chiu, Huanwang Yang, Chenghua Shao, W. Patrick Walters, Millard H. Lambert, Neysa Nevins, Scott D. Bembenek, Michael K. Ameriks, Tara Mirzadegan, Stephen K. Burley, Rommie E. Amaro, Michael K. Gilson. D3R Grand Challenge 3: blind prediction of protein-ligand poses and affinity rankings. Journal of Computer-Aided Molecular Design, 33(1):1-18, 2019. [doi]

Authors

Zied Gaieb

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Conor D. Parks

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Michael Chiu

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Huanwang Yang

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Chenghua Shao

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W. Patrick Walters

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Millard H. Lambert

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Neysa Nevins

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Scott D. Bembenek

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Michael K. Ameriks

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Tara Mirzadegan

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Stephen K. Burley

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Rommie E. Amaro

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Michael K. Gilson

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