Search Results - "Ma, Songling"
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Structural identification of vasodilator binding sites on the SUR2 subunit
Published in Nature communications (13-05-2022)“…ATP-sensitive potassium channels (K ATP ), composed of Kir6 and SUR subunits, convert the metabolic status of the cell into electrical signals. Pharmacological…”
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DORN1 and GORK regulate stomatal closure in Arabidopsis mediated by volatile organic compound ethyl vinyl ketone
Published in International journal of biological macromolecules (15-03-2023)“…Evk (ethyl vinyl ketone) is a signal substance for plant defense, but little is known about how evk mediates stomatal closure. Through stomatal biology…”
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Application scenario-oriented molecule generation platform developed for drug discovery
Published in Methods (San Diego, Calif.) (01-02-2024)“…[Display omitted] •Here we present an application scenario-oriented platform (ID4Idea) for molecule generation in different scenarios of drug discovery. This…”
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Clinical management of lung adenocarcinoma patients with HER2 V659E mutation
Published in Journal of clinical oncology (20-05-2020)“…Abstract only e21521 Background: ERBB2 mutations, mostly affecting the kinase domain (KD), were later found in the transmembrane domain (TMD), most frequently…”
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Incorporation of Hydrogen Bond Angle Dependency into the Generalized Solvation Free Energy Density Model
Published in Journal of chemical information and modeling (23-04-2018)“…To describe the physically realistic solvation free energy surface of a molecule in a solvent, a generalized version of the solvation free energy density…”
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Discovery of a small-molecule inhibitor of Dvl–CXXC5 interaction by computational approaches
Published in Journal of computer-aided molecular design (01-05-2018)“…The Wnt/β-catenin signaling pathway plays a significant role in the control of osteoblastogenesis and bone formation. CXXC finger protein 5 (CXXC5) has been…”
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Identification of small-molecule compounds targeting the dishevelled PDZ domain by virtual screening and binding studies
Published in Bioorganic & medicinal chemistry (01-08-2016)“…[Display omitted] The Dishevelled (Dvl) protein, which conveys signals from receptors to the downstream effectors, is a critical constituent of the…”
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PMFF: Development of a Physics-Based Molecular Force Field for Protein Simulation and Ligand Docking
Published in The journal of physical chemistry. B (13-02-2020)“…The physics-based molecular force field (PMFF) was developed by integrating a set of potential energy functions in which each term in an intermolecular…”
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Application scenario-oriented molecular generation platform developed for drug discovery
Published in Methods (San Diego, Calif.) (10-01-2024)“…Design of molecules for candidate compound selection is one of the central challenges in drug discovery due to the complexity of chemical space and requirement…”
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Structural insight into the antiprion compound inhibition mechanism of native prion folding over misfolding
Published in Chemical biology & drug design (01-06-2017)“…Transition of a physiological folded prion (PrPC) into a pathogenic misfolded prion (PrPSc) causes lethal neurodegenerative disorders and prion diseases…”
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