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| Enhanced receptor binding of SARS-CoV-2 through networks of hydrogen-bonding and hydrophobic interactions [期刊论文]
Proceedings of the National Academy of Sciences of the United States of America, 2020-01-01, 117 (25
Wang Y.; Liu M.; Gao J.
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| Atomic Resolution Insight into Sac7d Protein Binding to DNA and Associated Global Changes by Molecular Dynamics Simulations [期刊论文]
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2019-01-01, 58 (18) : 5967-5972
Zacharias, Martin
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| 兴安落叶松林球囊霉素相关土壤蛋白含量对年际间模拟氮沉降的响应 [期刊论文]
生态环境学报, 2019-01-01, 28 (3) : 894-904
黄彬彬; 邢亚娟; 闫国永; 王庆贵
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| Exploiting correlated molecular-dynamics networks to counteract enzyme activity–stability trade-off [期刊论文]
Proceedings of the National Academy of Sciences of the United States of America, 2018-01-01, 115 (52
Yu H.; Dalby P.A.
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| Combined molecular dynamics and neural network method for predicting protein antifreeze activity [期刊论文]
Proceedings of the National Academy of Sciences of the United States of America, 2018-01-01, 115 (52
Kozuch D.J.; Stillinger F.H.; Debenedetti P.G.
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| Structure of the emre multidrug transporter and its use for inhibitor peptide design [期刊论文]
Proceedings of the National Academy of Sciences of the United States of America, 2018-01-01, 115 (34
Ovchinnikov V.; Stone T.A.; Deber C.M.; Karplus M.
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| New free-exchange model of EmrE transport [期刊论文]
Proceedings of the National Academy of Sciences of the United States of America, 2017-01-01, 114 (47
Robinson A.E.; Thomas N.E.; Morrison E.A.; Balthazor B.M.; Henzler-Wildman K.A.
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| Entropy in molecular recognition by proteins [期刊论文]
Proceedings of the National Academy of Sciences of the United States of America, 2017-01-01, 114 (25
Caro J.A.; Harpole K.W.; Kasinath V.; Lim J.; Granja J.; Valentine K.G.; Sharp K.A.; Wand A.J.
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| ParCell: A Parallel Computation Framework for Scalable and Mechanistic Modeling and Simulation of Multicellular Systems [项目]
Dipak Barua
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| An overlooked source of N-nitrosamine precursors: Examining the role of biofilm in chloraminated drinking water distribution systems [项目]
Wen Zhang
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