Search Results - "Xu, Yechun"
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Structural basis for chemokine recognition and receptor activation of chemokine receptor CCR5
Published in Nature communications (06-07-2021)“…The chemokine receptor CCR5 plays a vital role in immune surveillance and inflammation. However, molecular details that govern its endogenous chemokine…”
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2
Identification of pyrogallol as a warhead in design of covalent inhibitors for the SARS-CoV-2 3CL protease
Published in Nature communications (15-06-2021)“…The ongoing pandemic of coronavirus disease 2019 (COVID-19) caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) urgently needs an effective…”
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3
Structural basis for inhibition of the RNA-dependent RNA polymerase from SARS-CoV-2 by remdesivir
Published in Science (American Association for the Advancement of Science) (26-06-2020)“…The pandemic of coronavirus disease 2019 (COVID-19), caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), has become a global crisis…”
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4
Structure-based design of antiviral drug candidates targeting the SARS-CoV-2 main protease
Published in Science (American Association for the Advancement of Science) (19-06-2020)“…SARS-CoV-2 (severe acute respiratory syndrome coronavirus 2) is the etiological agent responsible for the global COVID-19 (coronavirus disease 2019) outbreak…”
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5
Application of ITC-Based Characterization of Thermodynamic and Kinetic Association of Ligands With Proteins in Drug Design
Published in Frontiers in pharmacology (11-10-2018)“…A comprehensive characterization of the thermodynamic and kinetic profiling of ligands binding to a given target protein is crucial for the hit selection as…”
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Structural basis of ligand binding modes at the human formyl peptide receptor 2
Published in Nature communications (05-03-2020)“…The human formyl peptide receptor 2 (FPR2) plays a crucial role in host defense and inflammation, and has been considered as a drug target for chronic…”
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7
Potential treatment of COVID-19 by inhibitors of human dihydroorotate dehydrogenase
Published in Protein & cell (01-10-2020)Get full text
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8
The Molecular Mechanism Underlying Ligand Binding to the Membrane-Embedded Site of a G‑Protein-Coupled Receptor
Published in Journal of chemical theory and computation (08-05-2018)“…The crystal structure of P2Y1 receptor (P2Y1R), a class A GPCR, revealed a special extra-helical site for its antagonist, BPTU, which locates in-between the…”
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Recent Trends and Applications of Molecular Modeling in GPCR⁻Ligand Recognition and Structure-Based Drug Design
Published in International journal of molecular sciences (20-07-2018)“…G protein-coupled receptors represent the largest family of human membrane proteins and are modulated by a variety of drugs and endogenous ligands. Molecular…”
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10
Design and development of an oral remdesivir derivative VV116 against SARS-CoV-2
Published in Cell research (01-11-2021)Get full text
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11
A New Differentially-Fed Frequency Reconfigurable Antenna for WLAN and Sub-6GHz 5G Applications
Published in IEEE access (2019)“…A new differentially fed frequency reconfigurable antenna adopting proximity-coupling feeding for WLAN and sub-6-GHz 5G applications is proposed in this paper…”
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12
Globba Hongman, a Cut-flower Cultivar with Red Bract Color and Long Vase Life
Published in HortScience (01-10-2024)Get full text
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13
Design, Synthesis, and Biological Evaluation of Peptidomimetic Aldehydes as Broad-Spectrum Inhibitors against Enterovirus and SARS-CoV‑2
Published in Journal of medicinal chemistry (24-02-2022)“…A novel series of peptidomimetic aldehydes was designed and synthesized to target 3C protease (3Cpro) of enterovirus 71 (EV71). Most of the compounds exhibited…”
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14
Gorge Motions of Acetylcholinesterase Revealed by Microsecond Molecular Dynamics Simulations
Published in Scientific reports (12-06-2017)“…Acetylcholinesterase, with a deep, narrow active-site gorge, attracts enormous interest due to its particularly high catalytic efficiency and its inhibitors…”
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15
Structure-based development and preclinical evaluation of the SARS-CoV-2 3C-like protease inhibitor simnotrelvir
Published in Nature communications (13-10-2023)“…The persistent pandemic of coronavirus disease 2019 (COVID-19) caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) and its variants…”
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16
Pharmacological inhibition of dihydroorotate dehydrogenase induces apoptosis and differentiation in acute myeloid leukemia cells
Published in Haematologica (Roma) (01-09-2018)“…Acute myeloid leukemia is a disorder characterized by abnormal differentiation of myeloid cells and a clonal proliferation derived from primitive hematopoietic…”
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Characterization of EST-SSR markers in Curcuma kwangsiensis S. K. Lee & C. F. Liang based on RNA sequencing and its application for phylogenetic relationship analysis and core collection construction
Published in Genetic resources and crop evolution (01-04-2021)“…Curcuma kwangsiensis S. K. Lee & C. F. Liang, a traditional herb in southern China, accumulates substantial amounts of active components, curcuminoids and…”
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Computational Studies on Acetylcholinesterases
Published in Molecules (Basel, Switzerland) (10-08-2017)“…Functions of biomolecules, in particular enzymes, are usually modulated by structural fluctuations. This is especially the case in a gated diffusion-controlled…”
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Bispecific prodrug nanoparticles circumventing multiple immune resistance mechanisms for promoting cancer immunotherapy
Published in Acta pharmaceutica Sinica. B (01-06-2022)“…Cancer immunotherapy is impaired by the intrinsic and adaptive immune resistance. Herein, a bispecific prodrug nanoparticle was engineered for circumventing…”
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Pigment Diversity in Leaves of Caladium × hortulanum Birdsey and Transcriptomic and Metabolic Comparisons between Red and White Leaves
Published in International journal of molecular sciences (03-01-2024)“…Leaf color is a key ornamental characteristic of cultivated caladium ( × Birdsey), a plant with diverse leaf colors. However, the genetic improvement of leaf…”
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