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Identify potent SARS-CoV-2 main protease inhibitors via accelerated free energy perturbation-based virtual screening of existing drugs

Proceedings of the National Academy of Sciences - PNAS, 2020-11, Vol.117 (44), p.27381-27387

2020

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Design, Synthesis, and Evaluation of Multitarget-Directed Resveratrol Derivatives for the Treatment of Alzheimer’s Disease

Journal of medicinal chemistry, 2013-07, Vol.56 (14), p.5843-5859

2013

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PDE12 disrupts mitochondrial oxidative phosphorylation and mediates mitochondrial dysfunction to induce oral mucosal epithelial barrier damage in oral submucous fibrosis

European journal of pharmacology, 2024-03, Vol.967, p.176353-176353, Article 176353

2024

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3D-SMGE: a pipeline for scaffold-based molecular generation and evaluation

Briefings in bioinformatics, 2023-09, Vol.24 (6)

2023

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Therapeutic targets and potential agents for the treatment of COVID‐19

Medicinal research reviews, 2021-05, Vol.41 (3), p.1775-1797

2021

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Potential therapeutic effects of dipyridamole in the severely ill patients with COVID-19

Acta pharmaceutica Sinica. B, 2020-07, Vol.10 (7), p.1205-1215

2020

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Curved carbon photo-oxygenation catalysts for the suppression and nanoscopic imaging of β-amyloid peptides fibrillation

Nano research, 2022-04, Vol.15 (4), p.3387-3397

2022

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IL-17 production by tissue-resident MAIT cells is locally induced in children with pneumonia

Mucosal immunology, 2020-09, Vol.13 (5), p.824-835

2020

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One-Pot Synthesis of Deuterated Aldehydes from Arylmethyl Halides

Organic letters, 2018-04, Vol.20 (7), p.1712-1715

2018

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Regulation of Burkholderia cenocepacia virulence by the fatty acyl-CoA ligase DsfR as a response regulator of quorum sensing signal

Cell reports (Cambridge), 2024-05, Vol.43 (5), p.114223-114223, Article 114223

2024

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Discovery of catalytic-site-fluorescent probes for tracing phosphodiesterase 5 in living cells

RSC advances, 2021-10, Vol.11 (51), p.31967-31971

2021

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Morinda officinalis oligosaccharides increase serotonin in the brain and ameliorate depression via promoting 5-hydroxytryptophan production in the gut microbiota

Acta pharmaceutica Sinica. B, 2022-08, Vol.12 (8), p.3298-3312

2022

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Computational Design of a Time-Dependent Histone Deacetylase 2 Selective Inhibitor

ACS chemical biology, 2015-03, Vol.10 (3), p.687-692

2015

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Star-shaped triazine-cored ladder-type ter(-phenylene)s for high-performance multiphoton absorption and amplified spontaneous blue emission

Journal of materials chemistry. C, Materials for optical and electronic devices, 2020, Vol.8 (5), p.1768-1772

2020

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Free energy perturbation–based large-scale virtual screening for effective drug discovery against COVID-19

The international journal of high performance computing applications, 2023-01, Vol.37 (1), p.45-57

2023

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Single-Particle Enzyme Activity Assay with Spectral-Resolved Dark-Field Optical Microscopy

Analytical chemistry (Washington), 2019-05, Vol.91 (9), p.6329-6339

2019

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Structure-Based Discovery of Highly Selective Phosphodiesterase-9A Inhibitors and Implications for Inhibitor Design

Journal of medicinal chemistry, 2012-10, Vol.55 (19), p.8549-8558

2012

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Lightweight, Strong and High Heat-Resistant Poly(lactide acid) Foams via Microcellular Injection Molding with Self-Assembly Nucleating Agent

Chinese journal of polymer science, 2024-06, Vol.42 (6), p.739-750

2024

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Nobiletin and its derivatives overcome multidrug resistance (MDR) in cancer: total synthesis and discovery of potent MDR reversal agents

Acta pharmaceutica Sinica. B, 2020-02, Vol.10 (2), p.327-343

2020

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Ginsenoside Rg5 overcomes chemotherapeutic multidrug resistance mediated by ABCB1 transporter: in vitro and in vivo study

Journal of Ginseng Research, 2020, 44(2), , pp.247-257

2020

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Novel Phosphodiesterase Inhibitors for Cognitive Improvement in Alzheimer's Disease

Journal of medicinal chemistry, 2018-07, Vol.61 (13), p.5467-5483

2018

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Docking-assisted 3D-QSAR studies on xanthones as α-glucosidase inhibitors

Journal of molecular modeling, 2017-09, Vol.23 (9), p.272-12, Article 272

2017

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Enantiomeric Polyketides from the Starfish‐Derived Symbiotic Fungus Penicillium sp. GGF16‐1‐2

Chemistry & biodiversity, 2019-06, Vol.16 (6), p.e1900052-n/a

2019

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Heightened Local Th17 Cell Inflammation Is Associated with Severe Community-Acquired Pneumonia in Children under the Age of 1 Year

Mediators of inflammation, 2021, Vol.2021, p.1-13

2021

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Free energy perturbation (FEP)-guided scaffold hopping

Acta pharmaceutica Sinica. B, 2022-03, Vol.12 (3), p.1351-1362

2022

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Identify potent SARS-CoV-2 main protease inhibitors via accelerated free energy perturbation-based virtual screening of existing drugs

Design, Synthesis, and Evaluation of Multitarget-Directed Resveratrol Derivatives for the Treatment of Alzheimer’s Disease

PDE12 disrupts mitochondrial oxidative phosphorylation and mediates mitochondrial dysfunction to induce oral mucosal epithelial barrier damage in oral submucous fibrosis

3D-SMGE: a pipeline for scaffold-based molecular generation and evaluation

Therapeutic targets and potential agents for the treatment of COVID‐19

Potential therapeutic effects of dipyridamole in the severely ill patients with COVID-19

Curved carbon photo-oxygenation catalysts for the suppression and nanoscopic imaging of β-amyloid peptides fibrillation

IL-17 production by tissue-resident MAIT cells is locally induced in children with pneumonia

One-Pot Synthesis of Deuterated Aldehydes from Arylmethyl Halides

Regulation of Burkholderia cenocepacia virulence by the fatty acyl-CoA ligase DsfR as a response regulator of quorum sensing signal

Discovery of catalytic-site-fluorescent probes for tracing phosphodiesterase 5 in living cells

Morinda officinalis oligosaccharides increase serotonin in the brain and ameliorate depression via promoting 5-hydroxytryptophan production in the gut microbiota

Computational Design of a Time-Dependent Histone Deacetylase 2 Selective Inhibitor

Star-shaped triazine-cored ladder-type ter(-phenylene)s for high-performance multiphoton absorption and amplified spontaneous blue emission

Free energy perturbation–based large-scale virtual screening for effective drug discovery against COVID-19

Single-Particle Enzyme Activity Assay with Spectral-Resolved Dark-Field Optical Microscopy

Structure-Based Discovery of Highly Selective Phosphodiesterase-9A Inhibitors and Implications for Inhibitor Design

Lightweight, Strong and High Heat-Resistant Poly(lactide acid) Foams via Microcellular Injection Molding with Self-Assembly Nucleating Agent

Nobiletin and its derivatives overcome multidrug resistance (MDR) in cancer: total synthesis and discovery of potent MDR reversal agents

Ginsenoside Rg5 overcomes chemotherapeutic multidrug resistance mediated by ABCB1 transporter: in vitro and in vivo study

Novel Phosphodiesterase Inhibitors for Cognitive Improvement in Alzheimer's Disease

Docking-assisted 3D-QSAR studies on xanthones as α-glucosidase inhibitors

Enantiomeric Polyketides from the Starfish‐Derived Symbiotic Fungus Penicillium sp. GGF16‐1‐2

Heightened Local Th17 Cell Inflammation Is Associated with Severe Community-Acquired Pneumonia in Children under the Age of 1 Year

Free energy perturbation (FEP)-guided scaffold hopping

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