Yipin Lu

发表

The PDBbind database: methodologies and updates.

Renxiao Wang, Xueliang Fang, Yipin Lu, 2005, Journal of medicinal chemistry.

Structure-based design of spiro-oxindoles as potent, specific small-molecule inhibitors of the MDM2-p53 interaction.

Su Qiu, Guoping Wang, Wei Gao, 2006, Journal of medicinal chemistry.

Temporal activation of p53 by a specific MDM2 inhibitor is selectively toxic to tumors and leads to complete tumor growth inhibition

Dajun Yang, Su Qiu, Guoping Wang, 2008, Proceedings of the National Academy of Sciences.

Comparative evaluation of 11 scoring functions for molecular docking.

Renxiao Wang, Yipin Lu, Shaomeng Wang, 2003, Journal of medicinal chemistry.

The PDBbind database: collection of binding affinities for protein-ligand complexes with known three-dimensional structures.

Renxiao Wang, Xueliang Fang, Yipin Lu, 2004, Journal of medicinal chemistry.

Structure-based design of potent non-peptide MDM2 inhibitors.

J. Deschamps, Shaomeng Wang, Yipin Lu, 2005, Journal of the American Chemical Society.

Structure-Based Drug Design of Novel, Potent, and Selective Azabenzimidazoles (ABI) as ATR Inhibitors.

M. P. Dillon, M. Cox, Yipin Lu, 2015, ACS medicinal chemistry letters.

Structure-Based Drug Design of Novel Potent and Selective Tetrahydropyrazolo[1,5-a]pyrazines as ATR Inhibitors.

Yipin Lu, Jiong Lan, R. Jain, 2015, ACS medicinal chemistry letters.

Impact of molecular size on two antibiotics adsorption by porous resins

Yipin Lu, Weiben Yang, Miao Jiang, 2014 .

Investigation into adsorption mechanisms of sulfonamides onto porous adsorbents.

Yipin Lu, Fangfang Zheng, Weiben Yang, 2011, Journal of colloid and interface science.

Differences in energy metabolism and mitochondrial redox status account for the differences in propensity for developing obesity in rats fed on high‐fat diet

Yipin Lu, Xue Tang, Kai Zhang, 2021, Food science & nutrition.

Fragrant rapeseed oil consumption prevents blood cholesterol accumulation via promoting fecal bile excretion and reducing oxidative stress in high cholesterol diet fed rats

Yipin Lu, Kai Zhang, Tristan C. Liu, 2022, Journal of Functional Foods.

A comparison study of the influence of milk protein versus whey protein in high-protein diets on adiposity in rats.

Yipin Lu, P. Zhou, Xue Tang, 2021, Food & function.

Formation of a novel reversible cytochrome P450 spectral intermediate: role of threonine 303 in P450 2E1 inactivation.

Anna L. Blobaum, Shaomeng Wang, Yipin Lu, 2004, Biochemistry.

An artiﬁcial intelligence approach to pro-actively inspire drug discovery with recommendations.

Steven L. Rohall, M. Lindvall, N. Stiefl, 2020, Journal of medicinal chemistry.

Dietary dityrosine induce mitochondrial dysfunction by diminished thyroid hormone function in mouse myocardia.

Yipin Lu, Yueting Ge, Xue Tang, 2020, Journal of agricultural and food chemistry.

Discovery of Potent Pyrazoline-Based Covalent SARS-CoV-2 Main Protease Inhibitors

M. Schirle, J. Tallarico, D. Nomura, 2022, bioRxiv.

Adsorption Interaction of Tetracyclines with Porous Synthetic Resins

Yipin Lu, Fangfang Zheng, Weiben Yang, 2011 .

Efficient Screening of Target‐Specific Selected Compounds in Mixtures by 19F NMR Binding Assay with Predicted 19F NMR Chemical Shifts

Yipin Lu, A. Vulpetti, C. Dalvit, 2022, ChemMedChem.

Design, Synthesis, and Properties of a Potent Inhibitor of Pseudomonas aeruginosa Deacetylase LpxC.

M. Glick, L. Hamann, Yipin Lu, 2017, Journal of medicinal chemistry.

4-(Pyrazol-4-yl)-pyrimidines as selective inhibitors of cyclin-dependent kinase 4/6.

Rajiv Chopra, Sunkyu Kim, Ming Xu, 2010, Journal of medicinal chemistry.

Rationally Designed PI3Kα Mutants to Mimic ATR and Their Use to Understand Binding Specificity of ATR Inhibitors.

D. Bussiere, Yipin Lu, Li Zhang, 2017, Journal of molecular biology.

Discovery of a nanomolar inhibitor of the human murine double minute 2 (MDM2)-p53 interaction through an integrated, virtual database screening strategy.

Xueliang Fang, Su Qiu, Xueliang Fang, 2006, Journal of medicinal chemistry.

Adsorption behavior and mechanisms of norfloxacin onto porous resins and carbon nanotube

Na Li, Yipin Lu, Fangfang Zheng, 2012 .

Effects of Matrix and Functional Groups on Tylosin Adsorption onto Resins and Carbon Nanotubes

Yipin Lu, Weiben Yang, Miao Jiang, 2013, Water, Air, & Soil Pollution.

Prediction of pKa Using Machine Learning Methods with Rooted Topological Torsion Fingerprints: Application to Aliphatic Amines

Peter Gedeck, Brian Kelley, Weiping Jia, 2019, J. Chem. Inf. Model..

An Activity-Based Oxaziridine Platform for Identifying and Developing Covalent Ligands for Functional Allosteric Methionine Sites: Redox-Dependent Inhibition of Cyclin-Dependent Kinase 4.

Richard A. Lewis, John A. Tallarico, M. Schirle, 2022, Journal of the American Chemical Society.

Fragment-Based Discovery of 7-Azabenzimidazoles as Potent, Highly Selective, and Orally Active CDK4/6 Inhibitors.

Paul N. Mortenson, M. Congreve, R. Cheng, 2012, ACS medicinal chemistry letters.

Reactivation of p53 by a specific MDM2 antagonist (MI-43) leads to p21-mediated cell cycle arrest and selective cell death in colon cancer

Shaomeng Wang, Yipin Lu, T. Carey, 2008, Molecular Cancer Therapeutics.

Analysis of Ligand-Bound Water Molecules in High-Resolution Crystal Structures of Protein-Ligand Complexes

Renxiao Wang, Chao-Yie Yang, Shaomeng Wang, 2007, J. Chem. Inf. Model..

Structural and biological basis of small molecule inhibition of Escherichia coli LpxD acyltransferase essential for lipopolysaccharide biosynthesis.

Charles A. Wartchow, Yipin Lu, S. Ramurthy, 2019, ACS infectious diseases.

An Extensive Test of 14 Scoring Functions Using the PDBbind Refined Set of 800 Protein-Ligand Complexes

Shaomeng Wang, Renxiao Wang, Xueliang Fang, 2004, J. Chem. Inf. Model..

Structure-based discovery of nonpeptidic small organic compounds to block the T cell response to myelin basic protein.

Chao-Yie Yang, Xiongwu Wu, Yipin Lu, 2004, Journal of medicinal chemistry.

Enantiomerically pure hexahydropyrazinoquinolines as potent and selective dopamine 3 subtype receptor ligands.

J. Deschamps, Shaomeng Wang, Yipin Lu, 2005, Journal of medicinal chemistry.

Sodium butyrate protects against oxidative stress between obesity-prone and obesity-resistant rats induced by HFD through modulating Nrf2 pathway and mitochondrial function

Yipin Lu, Xue Tang, Kai Zhang, 2020 .

Binding free energy contributions of interfacial waters in HIV-1 protease/inhibitor complexes.

Chao-Yie Yang, Shaomeng Wang, Yipin Lu, 2006, Journal of the American Chemical Society.

An Extensive Test for 14 Scoring Functions Using the PDBbind Refined Set of 800 Protein—Ligand Complexes.

Renxiao Wang, Xueliang Fang, Yipin Lu, 2005 .

Discovery of a nanomolar inhibitor of the human murine double minute 2 (MDM2)-p53 interaction through an integrated, virtual database screening strategy.

Xueliang Fang, Su Qiu, Xueliang Fang, 2006, Journal of medicinal chemistry.

Benefit of Retraining pKa Models Studied Using Internally Measured Data

Peter Gedeck, Franco Lombardo, Weiping Jia, 2015, J. Chem. Inf. Model..