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1Subjects: “...molecular dynamics simulations...”
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2by Sanya Du (10525737), Xiaomin Han (304447), Liang Zheng (206933), Shijun Qin (8531952), Muhammad Arif (769250), Dongpeng Yan (1438297), Xiaohui Yu (303050), Hui Li (32376)Subjects: “...Molecular Dynamics Simulation Study....”
Published 2021
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3by Henrique F. Carvalho (11408021), Valerio Ferrario (651292), Jürgen Pleiss (1723024)Subjects: “...unbiased molecular dynamics...”
Published 2021
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4by Dilipkumar, S., Karthik, V., Dk, Shanmuganathan, Gowramma, Byran, Lakshmanan, Kaviarasan“..., and molecular dynamics simulation investigations. The docking studies of ligands against PARP1 and STAT3 were...”
Published 2023
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5by Dilipkumar, S., Karthik, V., Dk, Shanmuganathan, Gowramma, Byran, Lakshmanan, Kaviarasan“..., and molecular dynamics simulation investigations. The docking studies of ligands against PARP1 and STAT3 were...”
Published 2023
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6by Han Hu (131769), Jiayi Li (329430), Ying Tian (180972), Shenggan Luo (5100326), Jinggang Wang (4253491), Wu Bin Ying (5180249), Fenglong Li (9323832), Chao Chen (195669), Yi-Lei Zhao (800876), Ruoyu Zhang (504163), Jin Zhu (164147)Subjects: “...molecular dynamics...”
Published 1753
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7by Jing Wu (54032), Jiefei Qi (6041855), Yiming Lin (174403), Yong Chen (109188), Xu Zhang (49484), Rongliang Wu (117506), Huaping Wang (3632671)“... of their counterparts obtained by melt polymerization (MP). Molecular dynamics (MD) simulation revealed that the endo...”
Published 2021
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8by Nilesh Choudhary (5427656), Omkar Singh Kushwaha (3851341), Gaurav Bhattacharjee (1442899), Suman Chakrabarty (1631227), Rajnish Kumar (609557)“... as molecular dynamics (MD) simulation. Further, the Hofmeister effects on hydrate crystallization have been...”
Published 1753
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9“... Carlo and molecular dynamics methods to simulate the water–gas shift reaction in single-walled carbon...”
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10by Nicole Balasco (683009), Josephine Alba (5753309), Marco D’Abramo (472128), Luigi Vitagliano (204913)“... report molecular dynamics (MD) simulations by focusing on the relevance of the intermediate states...”
Published 2021
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11by Philip M. Kiefer (1777345), Snehasis Daschakraborty (1849987), Dina Pines (1777348), Ehud Pines (1777342), James T. Hynes (1581865)“..., 2271−2280; J. Phys. Chem. B 2016, 109, 2281–2290) via Car–Parinnello molecular dynamics. This proton...”
Published 2021
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12by Arun Siddarth Sridhar (14383925), Xiaoyu Chen (298872), Tobias Glossmann (8600703), Ziming Yang (1456855), Yong Xu (17491), Wei Lai (601813), Xiangqun Zeng (1414123)“... potential (OCP). Molecular dynamics simulations revealed insights into the structure and dynamics of the IL...”
Published 2023
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13“... abundances in subtropical and tropical soils. Applying force‐field molecular dynamics simulation together...”
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