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G

Gao Tu

Chongqing University

H指数:14

被引数:1,212

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CREB binding protein (CREBBP): Structure-based perspectives for the development of clinical inhibitors

CREB结合蛋白(CREBBP)：基于结构的临床抑制剂开发视角

Translational Oncology

IF4.1

2025-08-180

PREAI

Design, synthesis and activity evaluation of 4-(quinoline-2-yl)aniline derivatives as SARS-CoV-2 main protease inhibitors

BIOORGANIC & MEDICINAL CHEMISTRY

IF3

2025-02-010

PRE

Pathways and mechanism of MRTX1133 binding to KRAS G12D elucidated by molecular dynamics simulations and Markov state models

通过分子动力学模拟和马尔可夫状态模型阐明MRTX1133与KRAS G12D结合的途径和机理

INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES

IF8.5

2024-08-013

PRE

Computer-aided discovery of novel aryl hydrocarbon receptor ligands to regulate CYP1A1 expression in inflammatory macrophages

CHEMICAL BIOLOGY & DRUG DESIGN

IF3.3

2024-06-240

PRE

Discovery of Novel Noncovalent KRAS G12D Inhibitors through Structure-Based Virtual Screening and Molecular Dynamics Simulations

IF4.6

2024-03-101

OAAI

Computational Chemistry in Structure-Based Solute Carrier Transporter Drug Design: Recent Advances and Future Perspectives

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2024-01-315

PRE

Design and synthesis of isatin derivatives as effective SARS-CoV-2 3CL protease inhibitors

CHEMICAL BIOLOGY & DRUG DESIGN

IF3.3

2023-08-104

PRE

Multi-state Model-Based Identification of Cryptic Allosteric Sites on Human Serotonin Transporter

ACS CHEMICAL NEUROSCIENCE

IF3.9

2023-04-178

PRE

Unbiased molecular dynamics simulation of a first-in-class small molecule inhibitor binds to oncostatin M

COMPUTERS IN BIOLOGY AND MEDICINE

IF6.3

2023-03-015

PRE

Understanding the Polypharmacological Profiles of Triple Reuptake Inhibitors by Molecular Simulation

ACS CHEMICAL NEUROSCIENCE

IF3.9

2021-05-1220

PREAI

Subtype-selective mechanisms of negative allosteric modulators binding to group I metabotropic glutamate receptors

ACTA PHARMACOLOGICA SINICA

IF8.4

2020-10-2930

OAAI

Recent Advances and Challenges of the Drugs Acting on Monoamine Transporters

作用于单胺转运体的药物研究进展与挑战

CURRENT MEDICINAL CHEMISTRY

IF3.5

2020-07-0125

PREAI

Simultaneous Improvement in the Precision, Accuracy, and Robustness of Label-free Proteome Quantification by Optimizing Data Manipulation Chains

MOLECULAR & CELLULAR PROTEOMICS

IF5.5

2019-08-01101

OAAI

Prediction of GluN2B-CT1290-1310/DAPK1 Interaction by Protein-Peptide Docking and Molecular Dynamics Simulation

IF4.6

2018-11-1920

OAAI

Exploring the Binding Mechanism of Metabotropic Glutamate Receptor 5 Negative Allosteric Modulators in Clinical Trials by Molecular Dynamics Simulations

用分子动力学模拟探索代谢型谷氨酸受体5负变构调节剂在临床试验中的结合机制

ACS CHEMICAL NEUROSCIENCE

IF3.9

2018-03-09111

PREAI

Therapeutic target database update 2018: enriched resource for facilitating bench-to-clinic research of targeted therapeutics

NUCLEIC ACIDS RESEARCH

IF13.1

2017-11-13442

OAAI