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Liwei Li · SciRah

Researcher profile · Semantic Scholar

Liwei Li

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Liwei Li — researcher profile on SciRah

h-index: 16
Works: 23
Citations: 1,124

Most-cited papers

Large-Scale Assessment of Binding Free Energy Calculations in Active Drug Discovery Projects
Christina E. M. Schindler, Hannah Baumann, A. Blum, Dietrich Böse +33 more
2020Journal of Chemical Information and Modeling275 citations Open access
Semantic Scholar
Discovery and characterization of small molecules that target the Ral GTPase
Chao Yan, Degang Liu, Liwei Li, M. Wempe +16 more
2014Nature137 citations Open access
Semantic Scholar
Support Vector Regression Scoring of Receptor-Ligand Complexes for Rank-Ordering and Virtual Screening of Chemical Libraries
Liwei Li, Bo Wang, S. Meroueh
2011Journal of Chemical Information and Modeling92 citations Open access
Semantic Scholar
A computational investigation of allostery in the catabolite activator protein.
Liwei Li, V. Uversky, A. Dunker, S. Meroueh
2007Journal of the American Chemical Society78 citations
Semantic Scholar
Analysis of Structured and Intrinsically Disordered Regions of Transmembrane Proteins
B. Xue, Liwei Li, S. Meroueh, Vladimir N. Uversky +1 more
2009Molecular Biosystems68 citations Open access
Semantic Scholar
Targeting Multiple Conformations Leads to Small Molecule Inhibitors of the uPAR·uPA Protein-Protein Interaction that Block Cancer Cell Invasion
M. Khanna, Fang Wang, Inha Jo, W. Knabe +7 more
2011ACS Chemical Biology60 citations Open access
Semantic Scholar
PDBcal: A Comprehensive Dataset for Receptor–Ligand Interactions with Three‐dimensional Structures and Binding Thermodynamics from Isothermal Titration Calorimetry
Liwei Li, Justin J. Dantzer, J. Nowacki, Brian J. O'Callaghan +1 more
2008Chemical Biology and Drug Design57 citations
Semantic Scholar
Target-Specific Support Vector Machine Scoring in Structure-Based Virtual Screening: Computational Validation, In Vitro Testing in Kinases, and Effects on Lung Cancer Cell Proliferation
Liwei Li, M. Khanna, Inha Jo, Fang Wang +3 more
2011Journal of Chemical Information and Modeling55 citations Open access
Semantic Scholar
Exploring the Molecular Design of Protein Interaction Sites with Molecular Dynamics Simulations and Free Energy Calculations
Shi-De Liang, Liwei Li, Wei-Lun Hsu, Meaghan N. Pilcher +4 more
2009Biochemistry54 citations Open access
Semantic Scholar
Molecular Recognition in a Diverse Set of Protein-Ligand Interactions Studied with Molecular Dynamics Simulations and End-Point Free Energy Calculations
Bo Wang, Liwei Li, T. Hurley, S. Meroueh
2013Journal of Chemical Information and Modeling44 citations Open access
Semantic Scholar
Design, Synthesis, Biochemical Studies, Cellular Characterization, and Structure-Based Computational Studies of Small Molecules Targeting the Urokinase Receptor
Fang Wang, W. E. Knabe, Liwei Li, Inha Jo +6 more
2012Bioorganic & Medicinal Chemistry41 citations Open access
Semantic Scholar
BioDrugScreen: a computational drug design resource for ranking molecules docked to the human proteome
Liwei Li, K. Bum-Erdene, Peter H. Baenziger, Joshua J. Rosen +4 more
2009Nucleic Acids Res.34 citations Open access
Semantic Scholar
Virtual Screening Targeting the Urokinase Receptor, Biochemical and Cell-Based Studies, Synthesis, Pharmacokinetic Characterization, and Effect on Breast Tumor Metastasis
Fang Wang, Jing Li, A. Sinn, W. E. Knabe +11 more
2011Journal of Medicinal Chemistry29 citations Open access
Semantic Scholar
Docking Small Molecules to Predicted Off-Targets of the Cancer Drug Erlotinib Leads to Inhibitors of Lung Cancer Cell Proliferation with Suitable In vitro Pharmacokinetic Properties
Liwei Li, Jing Li, M. Khanna, Inha Jo +2 more
2010ACS Medicinal Chemistry Letters21 citations Open access
Semantic Scholar
Probing Binding and Cellular Activity of Pyrrolidinone and Piperidinone Small Molecules Targeting the Urokinase Receptor
Timmy Mani, Degang Liu, Donghui Zhou, Liwei Li +4 more
2013ChemMedChem19 citations Open access
Semantic Scholar
Enrichment of Chemical Libraries Docked to Protein Conformational Ensembles and Application to Aldehyde Dehydrogenase 2
Bo Wang, C. Buchman, Liwei Li, T. Hurley +1 more
2014Journal of Chemical Information and Modeling18 citations Open access
Semantic Scholar
Exploring a Structural Protein-Drug Interactome for New Therapeutics in Lung Cancer
Xiaodong Peng, Fang Wang, Liwei Li, K. Bum-Erdene +9 more
2014Molecular Biosystems15 citations Open access
Semantic Scholar
Structure-Based Target-Specific Screening Leads to Small-Molecule CaMKII Inhibitors
David Xu, Liwei Li, Donghui Zhou, Degang Liu +2 more
2017ChemMedChem14 citations Open access
Semantic Scholar
Incorporating receptor flexibility in the molecular design of protein interfaces.
Liwei Li, Shi-De Liang, M. M. Pilcher, S. Meroueh
2009Protein engineering, design & selection : PEDS12 citations
Semantic Scholar
Discovery and characterization of small molecules that target the Ral GTPase
Chao Yan, Degang Liu, Liwei Li, M. Wempe +15 more
20141 citations
Semantic Scholar
Computational Design of Protein Interfaces with Receptor Flexibility
S. Meroueh, Shi-De Liang, Liwei Li
20101 citations Open access
Semantic Scholar
Receptor–Ligand Interactions in Biological Systems
Liwei Li, S. Meroueh
20081 citations
Semantic Scholar
Abstract C54: In silico docking of the human cancer proteome in search of multitarget cancer therapeutics
S. Meroueh, Liwei Li, K. Bum-Erdene
20090 citations
Semantic Scholar

Frequent co-authors

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S. Meroueh×22
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S. Meroueh — researcher profile on SciRah
M. Khanna×7
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M. Khanna — researcher profile on SciRah
Inha Jo×5
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Inha Jo — researcher profile on SciRah
Degang Liu×4
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Degang Liu — researcher profile on SciRah

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K. Bum-Erdene — researcher profile on SciRah

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Jing Li — researcher profile on SciRah

Bo Wang×3

Shi-De Liang×3

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Shi-De Liang — researcher profile on SciRah

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W. E. Knabe — researcher profile on SciRah

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Kyungsoo Oh — researcher profile on SciRah

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Chao Yan — researcher profile on SciRah

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M. Wempe — researcher profile on SciRah