[ACS] An OpenMM-BasedML/MM每MMGBSA Workflow for End-pointProtein每Ligand Binding Energy Ranking |
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Diverse Edge andExcitonic States of Ta2Ni3Te5 Nanoribbonsand Monolayer: Implicationsfor Nanoelectronics
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An OpenMM-BasedML/MM每MMGBSA Workflow for End-pointProtein每Ligand Binding Energy Ranking
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Room-Temperature Altermagnetic Nb2OX2(X = S, Se, Te) Monolayers with Controllable Valley Polarization: Implications to Spintronic Devices
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Strong Vertical Piezoelectricity of CuGeTeBr and CuGeTeI Monolayers: Promising Candidates for Flexible Nanoscale Piezoelectric Devices
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Ultrafast Microwave Synthesis of Ru-Doped MoP with Abundant P Vacancies as the Electrocatalyst for Hydrogen Generation in a Wide pH Range
