Search Results - "Xiang, Qun"
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Computational Fragment-Based Drug Design: Current Trends, Strategies, and Applications
Published in The AAPS journal (09-04-2018)“…Fragment-based drug design (FBDD) has become an effective methodology for drug development for decades. Successful applications of this strategy brought both…”
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Deep Learning for Drug Design: an Artificial Intelligence Paradigm for Drug Discovery in the Big Data Era
Published in The AAPS journal (30-03-2018)“…Over the last decade, deep learning (DL) methods have been extremely successful and widely used to develop artificial intelligence (AI) in almost every domain,…”
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3
Generative chemistry: drug discovery with deep learning generative models
Published in Journal of molecular modeling (04-02-2021)“…The de novo design of molecular structures using deep learning generative models introduces an encouraging solution to drug discovery in the face of the…”
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Gestational Hypoxia and Developmental Plasticity
Published in Physiological reviews (01-07-2018)“…Hypoxia is one of the most common and severe challenges to the maintenance of homeostasis. Oxygen sensing is a property of all tissues, and the response to…”
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TET2 confers a mechanistic link of microRNA‐210 and mtROS in hypoxia‐suppressed spontaneous transient outward currents in uterine arteries of pregnant sheep
Published in The Journal of physiology (01-04-2023)“…Hypoxia during pregnancy impairs uterine vascular adaptation via microRNA‐210 (miR‐210)‐mediated mitochondrial dysfunction and mitochondrial reactive oxygen…”
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A low temperature formaldehyde gas sensor based on hierarchical SnO/SnO2 nano-flowers assembled from ultrathin nanosheets: Synthesis, sensing performance and mechanism
Published in Sensors and actuators. B, Chemical (01-09-2019)“…[Display omitted] •Hierarchical SnO/SnO2 nano-flowers were successfully synthesized through a nanosheets self-assembly route under a mild hydrothermal…”
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Hypoxia and the integrated stress response promote pulmonary hypertension and preeclampsia: Implications in drug development
Published in Drug discovery today (01-11-2021)“…•Hypoxia is a common cause of pulmonary hypertension and preeclampsia.•Mitochondria and endoplasmic reticulum (ER) are the main targets of the hypoxic…”
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Effects of All-Atom Molecular Mechanics Force Fields on Amyloid Peptide Assembly: The Case of Aβ16–22 Dimer
Published in Journal of chemical theory and computation (12-02-2019)“…We investigated the effects of 17 widely used atomistic molecular mechanics force fields (MMFFs) on the structures and kinetics of amyloid peptide assembly. To…”
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Cryo-EM Structure of the Human Cannabinoid Receptor CB2-Gi Signaling Complex
Published in Cell (20-02-2020)“…Drugs selectively targeting CB2 hold promise for treating neurodegenerative disorders, inflammation, and pain while avoiding psychotropic side effects mediated…”
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10
Mitochondrial Dysfunction in the Pathogenesis of Preeclampsia
Published in Current hypertension reports (01-06-2022)“…Purpose of Review Preeclampsia complicates 5–10% of all pregnancies and is a leading cause of maternal and perinatal mortality and morbidity. The placenta…”
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SQSTM1/p62: A Potential Target for Neurodegenerative Disease
Published in ACS chemical neuroscience (15-05-2019)“…Neurodegenerative diseases, characterized by a progressive loss of brain function, affect the lives of millions of individuals worldwide. The complexity of the…”
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Roles and mechanisms of exosomal non-coding RNAs in human health and diseases
Published in Signal transduction and targeted therapy (10-11-2021)“…Exosomes play a role as mediators of cell-to-cell communication, thus exhibiting pleiotropic activities to homeostasis regulation. Exosomal non-coding RNAs…”
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AlzPlatform: An Alzheimer’s Disease Domain-Specific Chemogenomics Knowledgebase for Polypharmacology and Target Identification Research
Published in Journal of chemical information and modeling (28-04-2014)“…Alzheimer’s disease (AD) is one of the most complicated progressive neurodegeneration diseases that involve many genes, proteins, and their complex…”
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14
Development and Testing of Druglike Screening Libraries
Published in Journal of chemical information and modeling (28-01-2019)“…Although significant advances in experimental high throughput screening (HTS) have been made for drug lead identification, in silico virtual screening (VS) is…”
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MicroRNA‐210‐mediated mtROS confer hypoxia‐induced suppression of STOCs in ovine uterine arteries
Published in British journal of pharmacology (01-10-2022)“…Background and Purpose Hypoxia during pregnancy is associated with increased uterine vascular resistance and elevated blood pressure both in women and female…”
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Ca2+-Activated K+ Channels and the Regulation of the Uteroplacental Circulation
Published in International journal of molecular sciences (10-01-2023)“…Adequate uteroplacental blood supply is essential for the development and growth of the placenta and fetus during pregnancy. Aberrant uteroplacental perfusion…”
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Long‐term high altitude hypoxia during gestation suppresses large conductance Ca2+‐activated K+ channel function in uterine arteries: a causal role for microRNA‐210
Published in The Journal of physiology (01-12-2018)“…Key points Gestational hypoxia represses ten–eleven translocation methylcytosine dioxygenase 1 (TET1) expression in uterine arteries, which is recovered by…”
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Hypoxia and Mitochondrial Dysfunction in Pregnancy Complications
Published in Antioxidants (08-03-2021)“…Hypoxia is a common and severe stress to an organism's homeostatic mechanisms, and hypoxia during gestation is associated with significantly increased…”
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Decreased Risk of Radiation Pneumonitis With Incidental Concurrent Use of Angiotensin-Converting Enzyme Inhibitors and Thoracic Radiation Therapy
Published in International journal of radiation oncology, biology, physics (01-09-2012)“…Purpose Angiotensin-converting enzyme (ACE) inhibitors have been shown to mitigate radiation-induced lung injury in preclinical models. The aim of this study…”
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Function and regulation of large conductance Ca(2+)-activated K+ channel in vascular smooth muscle cells
Published in Drug discovery today (01-09-2012)“…Large conductance Ca(2+)-activated K(+) (BK(Ca)) channels are abundantly expressed in vascular smooth muscle cells. Activation of BK(Ca) channels leads to…”
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