Publications by authors named "Jerry Ebalunode"

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Functional and structural characterization of Hyp730, a highly conserved and dormancy-specific hypothetical membrane protein.
Stewart Fannin, Jonathan Rangel, Abiodun P Bodurin, Tannon Yu, Brandon Mistretta, Jerry O Ebalunode

Microbiologyopen· January 2021

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Screening of Focused Compound Library Targeting Liver X Receptors in Pancreatic Cancer Identified Ligands with Inverse Agonist and Degrader Activity.
Husna Karaboga, Wentao Huang, Shivangi Srivastava, Scott Widmann, Sridevi Addanki, Jerry O Ebalunode

ACS Chem Biol· November 2020

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Insights into the substrate binding specificity of quorum-quenching acylase PvdQ.
Yanyun Liu, Jerry O Ebalunode, James M Briggs

J Mol Graph Model· May 2019

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Receptor-based pharmacophore and pharmacophore key descriptors for virtual screening and QSAR modeling.
Xialan Dong, Jerry O Ebalunode, Sheng-Yong Yang, Weifan Zheng

Curr Comput Aided Drug Des· September 2011

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Informatics approach to the rational design of siRNA libraries.
Jerry O Ebalunode, Charles Jagun, Weifan Zheng

Methods Mol Biol· February 2011

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Application of QSAR and shape pharmacophore modeling approaches for targeted chemical library design.
Jerry O Ebalunode, Weifan Zheng, Alexander Tropsha

Methods Mol Biol· February 2011

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Molecular shape technologies in drug discovery: methods and applications.
Jerry O Ebalunode, Weifan Zheng

Curr Top Med Chem· December 2010

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Cheminformatics Approach to Gene Silencing: Z Descriptors of Nucleotides and SVM Regression Afford Predictive Models for siRNA Potency.
Jerry O Ebalunode, Weifan Zheng

Mol Inform· December 2010

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A novel structure-based multimode QSAR method affords predictive models for phosphodiesterase inhibitors.
Xialan Dong, Jerry O Ebalunode, Sung Jin Cho, Weifan Zheng

J Chem Inf Model· February 2010

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Development of improved models for phosphodiesterase-4 inhibitors with a multi-conformational structure-based QSAR method.
Adetokunbo Adekoya, Xialan Dong, Jerry Ebalunode, Weifan Zheng

Curr Chem Genomics· December 2009

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Structure-based shape pharmacophore modeling for the discovery of novel anesthetic compounds.
Jerry O Ebalunode, Xialan Dong, Zheng Ouyang, Jie Liang, Roderic G Eckenhoff

Bioorg Med Chem· July 2009

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Unconventional 2D shape similarity method affords comparable enrichment as a 3D shape method in virtual screening experiments.
Jerry Osagie Ebalunode, Weifan Zheng

J Chem Inf Model· June 2009

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Computational insights into the interaction of the anthrax lethal factor with the N-terminal region of its substrates.
Manali Joshi, Jerry Osagie Ebalunode, James M Briggs

Proteins· May 2009

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A single-residue mutation destabilizes Vibrio harveyi flavin reductase FRP dimer.
Navneet Jawanda, Jerry Ebalunode, Alexey Gribenko, James Briggs, J Ching Lee

Arch Biochem Biophys· April 2008

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Novel approach to structure-based pharmacophore search using computational geometry and shape matching techniques.
Jerry Osagie Ebalunode, Zheng Ouyang, Jie Liang, Weifan Zheng

J Chem Inf Model· April 2008

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Hybrid quantum mechanical/molecular mechanical molecular dynamics simulations of HIV-1 integrase/inhibitor complexes.
Nadtanet Nunthaboot, Somsak Pianwanit, Vudhichai Parasuk, Jerry O Ebalunode, James M Briggs

Biophys J· November 2007

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Electrostatic steering at acetylcholine binding sites.
Robert H Meltzer, Errol Thompson, Kizhake V Soman, Xing-Zhi Song, Jerry O Ebalunode

Biophys J· August 2006

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Computed pore potentials of the nicotinic acetylcholine receptor.
Robert H Meltzer, Wanda Vila-Carriles, Jerry O Ebalunode, James M Briggs, Steen E Pedersen

Biophys J· August 2006

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The 1.9 A crystal structure of alanine racemase from Mycobacterium tuberculosis contains a conserved entryway into the active site.
Pierre LeMagueres, Hookang Im, Jerry Ebalunode, Ulrich Strych, Michael J Benedik

Biochemistry· February 2005

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