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Leyun Wu

Showing results (11-20 of 21) with videos related to

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Signal Transduction and Targeted Therapy|January 6, 2022
SARS-CoV-2 Omicron RBD shows weaker binding affinity than the currently dominant Delta variant to human ACE2Leyun Wu, Liping Zhou, Mengxia Mo, et al.
Journal of Chemical Information and Modeling|February 25, 2026
A Neural Time-Series Learning Method for Accelerating Free-Energy Perturbation and Rare-Event Molecular Dynamics SimulationsMengxia Mo, Haiyang Yu, Chengkun Wu, et al.
Computers in Biology and Medicine|March 9, 2024
Unexpected effect of halogenation on the water solubility of small organic compoundsJianfang Zhang, Kinga Virág Gulyás, Jintian Li, et al.
Journal of Medicinal Chemistry|July 3, 2025
Hydrogen Bond-Induced Binding between Organofluorine and Protein via Fluorine Atoms: A Database Survey and Quantum Chemistry Calculation StudyZijian Han, Jintian Li, Qingyi Liao, et al.
Journal of Chemical Information and Modeling|September 2, 2022
Exploring the Binding Affinity and Mechanism between ACE2 and the Trimers of Delta and Omicron Spike Proteins by Molecular Dynamics Simulation and BioassayLiping Zhou, Tingting Liu, Mengxia Mo, et al.
Computers in Biology and Medicine|August 3, 2023
D3CARP: a comprehensive platform with multiple-conformation based docking, ligand similarity search and deep learning approaches for target prediction and virtual screeningYulong Shi, Xinben Zhang, Yanqing Yang, et al.
Emerging Microbes & Infections|June 26, 2024
Identification of the VP37 pocket of monkeypox virus as a promising target for pan-orthopoxvirus inhibitors through virtual screening and antiviral assaysShuting Huo, Leyun Wu, Baoying Huang, et al.
Briefings in Bioinformatics|April 20, 2022
D3AI-CoV: a deep learning platform for predicting drug targets and for virtual screening against COVID-19Yanqing Yang, Deshan Zhou, Xinben Zhang, et al.
Journal of the American Chemical Society|April 28, 2026
Probing Weak Halogen Bonding in Aqueous SolutionManuel A Herbst, Leyun Wu, Yannik T Woordes, et al.
Computers in Biology and Medicine|January 7, 2023
Molecular dynamics study on the behavior and binding mechanism of target protein Transgelin-2 with its agonist TSG12 for anti-asthma drug discoveryLeyun Wu, Guangpu Wang, Liping Zhou, et al.
Pageof 3

Showing results (11-20 of 21) with videos related to

Sort By:
Pageof 3
Signal Transduction and Targeted Therapy|January 6, 2022
SARS-CoV-2 Omicron RBD shows weaker binding affinity than the currently dominant Delta variant to human ACE2Leyun Wu, Liping Zhou, Mengxia Mo, et al.
Journal of Chemical Information and Modeling|February 25, 2026
A Neural Time-Series Learning Method for Accelerating Free-Energy Perturbation and Rare-Event Molecular Dynamics SimulationsMengxia Mo, Haiyang Yu, Chengkun Wu, et al.
Computers in Biology and Medicine|March 9, 2024
Unexpected effect of halogenation on the water solubility of small organic compoundsJianfang Zhang, Kinga Virág Gulyás, Jintian Li, et al.
Journal of Medicinal Chemistry|July 3, 2025
Hydrogen Bond-Induced Binding between Organofluorine and Protein via Fluorine Atoms: A Database Survey and Quantum Chemistry Calculation StudyZijian Han, Jintian Li, Qingyi Liao, et al.
Journal of Chemical Information and Modeling|September 2, 2022
Exploring the Binding Affinity and Mechanism between ACE2 and the Trimers of Delta and Omicron Spike Proteins by Molecular Dynamics Simulation and BioassayLiping Zhou, Tingting Liu, Mengxia Mo, et al.
Computers in Biology and Medicine|August 3, 2023
D3CARP: a comprehensive platform with multiple-conformation based docking, ligand similarity search and deep learning approaches for target prediction and virtual screeningYulong Shi, Xinben Zhang, Yanqing Yang, et al.
Emerging Microbes & Infections|June 26, 2024
Identification of the VP37 pocket of monkeypox virus as a promising target for pan-orthopoxvirus inhibitors through virtual screening and antiviral assaysShuting Huo, Leyun Wu, Baoying Huang, et al.
Briefings in Bioinformatics|April 20, 2022
D3AI-CoV: a deep learning platform for predicting drug targets and for virtual screening against COVID-19Yanqing Yang, Deshan Zhou, Xinben Zhang, et al.
Journal of the American Chemical Society|April 28, 2026
Probing Weak Halogen Bonding in Aqueous SolutionManuel A Herbst, Leyun Wu, Yannik T Woordes, et al.
Computers in Biology and Medicine|January 7, 2023
Molecular dynamics study on the behavior and binding mechanism of target protein Transgelin-2 with its agonist TSG12 for anti-asthma drug discoveryLeyun Wu, Guangpu Wang, Liping Zhou, et al.
Pageof 3