Yongtao Xu

Xinxiang, 453003, China

Last Updated: 09/26/2026

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Found 34 publications

Fragment-based discovery of novel Baicalein derivatives as triple-target 3CLpro/PLpro/RdRp inhibitors against SARS-CoV-2.

Fragment-based discovery of novel Baicalein derivatives as triple-target 3CLpro/PLpro/RdRp inhibitors against SARS-CoV-2.

Journal: Bioorganic chemistry

Published: May 05, 2026

Integrated deep learning and multi-scale modeling for the discovery of pan-genotypic HCV NS5B polymerase inhibitors.

Integrated deep learning and multi-scale modeling for the discovery of pan-genotypic HCV NS5B polymerase inhibitors.

Journal: Molecular diversity

Published: March 12, 2026

The influence of a type I antifreeze protein and its mutants on methane hydrate adsorption-inhibition: A molecular dynamics simulation study.

The influence of a type I antifreeze protein and its mutants on methane hydrate adsorption-inhibition: A molecular dynamics simulation study.

Journal: The Journal of chemical physics

Published: February 11, 2026

Virtual screening, optimization design, and synthesis analysis of novel benzofuran derivatives as pan-genotypic HCV NS5B polymerase inhibitors using molecular modeling.

Virtual screening, optimization design, and synthesis analysis of novel benzofuran derivatives as pan-genotypic HCV NS5B polymerase inhibitors using molecular modeling.

Journal: BMC chemistry

Published: March 04, 2025

Predicting Treatment Response of Repetitive Transcranial Magnetic Stimulation in Major Depressive Disorder Using an Explainable Machine Learning Model Based on Electroencephalography and Clinical Features.

Predicting Treatment Response of Repetitive Transcranial Magnetic Stimulation in Major Depressive Disorder Using an Explainable Machine Learning Model Based on Electroencephalography and Clinical Features.

Journal: Biological psychiatry. Cognitive neuroscience and neuroimaging

Published: November 04, 2024

Characterization and rational engineering of an alkaline-tolerant azoreductase derived from Roseibium sp. H3510 for enhanced decolorization of azo dyes.

Characterization and rational engineering of an alkaline-tolerant azoreductase derived from Roseibium sp. H3510 for enhanced decolorization of azo dyes.

Journal: International journal of biological macromolecules

Published: August 16, 2024

Common and differential EEG microstate of major depressive disorder patients with and without response to rTMS treatment.

Common and differential EEG microstate of major depressive disorder patients with and without response to rTMS treatment.

Journal: Journal of affective disorders

Published: July 17, 2024

Abnormal nonlinear features of EEG microstate sequence in obsessive-compulsive disorder.

Abnormal nonlinear features of EEG microstate sequence in obsessive-compulsive disorder.

Journal: BMC psychiatry

Published: June 23, 2024

Distinct Characteristic Binding Modes of Benzofuran Core Inhibitors to Diverse Genotypes of Hepatitis C Virus NS5B Polymerase: A Molecular Simulation Study.

Distinct Characteristic Binding Modes of Benzofuran Core Inhibitors to Diverse Genotypes of Hepatitis C Virus NS5B Polymerase: A Molecular Simulation Study.

Journal: International journal of molecular sciences

Published: June 21, 2024

Unraveling the Binding Mode of Cyclic Adenosine-Inosine Monophosphate (cAIMP) to STING through Molecular Dynamics Simulations.

Unraveling the Binding Mode of Cyclic Adenosine-Inosine Monophosphate (cAIMP) to STING through Molecular Dynamics Simulations.

Journal: Molecules (Basel, Switzerland)

Published: April 30, 2024

Lysine-Specific Demethylase 1 Inhibitors: A Comprehensive Review Utilizing Computer-Aided Drug Design Technologies.

Lysine-Specific Demethylase 1 Inhibitors: A Comprehensive Review Utilizing Computer-Aided Drug Design Technologies.

Journal: Molecules (Basel, Switzerland)

Published: November 29, 2023

Regioselective synthesis of indazolo[2,3-a]quinazolines enabled by I2/S-facilitated annulation relay dehydrogenative aromatization of cyclohexanones.

Regioselective synthesis of indazolo[2,3-a]quinazolines enabled by I2/S-facilitated annulation relay dehydrogenative aromatization of cyclohexanones.

Journal: Chemical communications (Cambridge, England)

Published: November 03, 2023

Showing 1-12 of 34

Last Updated: 09/26/2026