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Methods in Molecular Biology (Clifton, N.J.)|October 1, 2021
In Silico Analysis of Peptide Macrocycle -Protein InteractionsMargaret M Hurley, Meagan C SmallPlos Computational Biology|June 21, 2013
Impact of ribosomal modification on the binding of the antibiotic telithromycin using a combined grand canonical monte carlo/molecular dynamics simulation approachMeagan C Small, Pedro Lopes, Rodrigo B Andrade, et al.Journal of Computer-Aided Molecular Design|February 13, 2017
Drude polarizable force field for aliphatic ketones and aldehydes, and their associated acyclic carbohydratesMeagan C Small, Asaminew H Aytenfisu, Fang-Yu Lin, et al.The Journal of Physical Chemistry. A|February 25, 2009
Unimolecular decomposition of 5-aminotetrazole and its tautomer 5-iminotetrazole: new insight from isopotential searchingKristian W Paul, Margaret M Hurley, Karl K IrikuraCurrent Topics in Medicinal Chemistry|February 4, 2006
Acetylcholinesterase: molecular modeling with the whole toolkitGerald H Lushington, Jian-Xin Guo, Margaret M HurleyMolecules (Basel, Switzerland)|November 12, 2016
Unraveling the Roots of Selectivity of Peptide Affinity Reagents for Structurally Similar Ribosomal Inactivating Protein DerivativesDeborah A Sarkes, Margaret M Hurley, Dimitra N Stratis-CullumChemico-Biological Interactions|November 18, 2005
Interactions of organophosphorus and related compounds with cholinesterases, a theoretical studyMargaret M Hurley, Alex Balboa, Gerald H Lushington, et al.Journal of Medicinal Chemistry|October 16, 2004
A docking score function for estimating ligand-protein interactions: application to acetylcholinesterase inhibitionJianxin Guo, Margaret M Hurley, Jeffery B Wright, et al.ACS Medicinal Chemistry Letters|January 29, 2014
Desmethyl Macrolides: Synthesis and Evaluation of 4,8,10-Tridesmethyl CethromycinBharat Wagh, Tapas Paul, Charles Debrosse, et al.Colloids and Surfaces. B, Biointerfaces|April 14, 2021
Direct conjugation of fluorescent quantum dots with E. coli via surface-displayed histidine-containing peptidesHong Dong, Deborah A Sarkes, Dimitra N Stratis-Cullum, et al.Pageof 3