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Michael Klein

Email
Center AffiliationsMolecular Therapeutics

Publications (66) (print view)

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Galal Osman A, Elokely KM, Yadav VK, Carvalho P, Radwan M, Slade D, Gul W, Khan S, Dale OR, Husni AS, Klein ML, Cutler SJ, Ross SA, ElSohly MA. Bioactive products from singlet oxygen photooxygenation of cannabinoids. European journal of medicinal chemistry. 2018 Jan;143:983-96.
Xiao Q, Ludwig AK, Romano C, Buzzacchera I, Sherman SE, Vetro M, Vertesy S, Kaltner H, Reed EH, Moller M, Wilson CJ, Hammer DA, Oscarson S, Klein ML, Gabius HJ, Percec V. Exploring functional pairing between surface glycoconjugates and human galectins using programmable glycodendrimersomes. Proc Natl Acad Sci U S A. 2018 Jan 30;.
Carnevale V, Klein ML. Small molecule modulation of voltage gated sodium channels. Current opinion in structural biology. 2017 Apr;43:156-62.   PMCID: PMC5420475
Chen M, Ko HY, Remsing RC, Calegari Andrade MF, Santra B, Sun Z, Selloni A, Car R, Klein ML, Perdew JP, Wu X. Ab initio theory and modeling of water. Proc Natl Acad Sci U S A. 2017 Oct 10;114(41):10846-51.   PMCID: PMC5642722
Debenedetti PG, Klein ML. Chemical physics of water. Proc Natl Acad Sci U S A. 2017 Dec 19;114(51):13325-6.
Xiao Q, Sherman SE, Wilner SE, Zhou X, Dazen C, Baumgart T, Reed EH, Hammer DA, Shinoda W, Klein ML, Percec V. Janus dendrimersomes coassembled from fluorinated, hydrogenated, and hybrid Janus dendrimers as models for cell fusion and fission. Proc Natl Acad Sci U S A. 2017 Aug 22;114(34):E7045-e7053.   PMCID: PMC5576825
Xu B, Chakraborty H, Yadav VK, Zhang Z, Klein ML, Ren S. Author Correction: Tunable two-dimensional interfacial coupling in molecular heterostructures. Nat Commun. 2017 Nov 17;8(1):1699.   PMCID: PMC5693927
Xu B, Chakraborty H, Yadav VK, Zhang Z, Klein ML, Ren S. Tunable two-dimensional interfacial coupling in molecular heterostructures. Nat Commun. 2017 Aug 22;8(1):312.   PMCID: PMC5567094
Yadav VK, Klein ML. Probing the dynamics of N-methylacetamide in methanol via ab initio molecular dynamics. Physical chemistry chemical physics : PCCP. 2017 May 24;19(20):12868-75.
Elokely K, Velisetty P, Delemotte L, Palovcak E, Klein ML, Rohacs T, Carnevale V. Understanding TRPV1 activation by ligands: Insights from the binding modes of capsaicin and resiniferatoxin. Proc Natl Acad Sci U S A. 2016 Jan 12;113(2):E137-45.   PMCID: PMC4720335
Dong H, Li W, Sun J, Li S, Klein ML. Understanding the Boron-Nitrogen Interaction and Its Possible Implications in Drug Design. J Phys Chem B. 2015 Nov 12;119(45):14393-401.
Gianti E, Carnevale V, DeGrado WF, Klein ML, Fiorin G. Hydrogen-bonded water molecules in the M2 channel of the influenza A virus guide the binding preferences of ammonium-based inhibitors. J Phys Chem B. 2015 Jan 22;119(3):1173-83.   PMCID: PMC4386636
Gosselin-Badaroudine P, Moreau A, Delemotte L, Cens T, Collet C, Rousset M, Charnet P, Klein ML, Chahine M. Characterization of the honeybee AmNaV1 channel and tools to assess the toxicity of insecticides. Sci Rep. 2015 Jul 23;5:12475.   PMCID: 4894402
Kawamoto S, Klein ML, Shinoda W. Coarse-grained molecular dynamics study of membrane fusion: Curvature effects on free energy barriers along the stalk mechanism. J Chem Phys. 2015 Dec 28;143(24):243112.
MacDermaid CM, Kashyap HK, DeVane RH, Shinoda W, Klauda JB, Klein ML, Fiorin G. Molecular dynamics simulations of cholesterol-rich membranes using a coarse-grained force field for cyclic alkanes. J Chem Phys. 2015 Dec 28;143(24):243144.
Moreau A, Gosselin-Badaroudine P, Delemotte L, Klein ML, Chahine M. Gating pore currents are defects in common with two Nav1.5 mutations in patients with mixed arrhythmias and dilated cardiomyopathy. J Gen Physiol. 2015 Feb;145(2):93-106.   PMCID: PMC4306709
Moreau A, Gosselin-Badaroudine P, Delemotte L, Klein ML, Chahine M. Gating pore currents are defects in common with two Nav1.5 mutations in patients with mixed arrhythmias and dilated cardiomyopathy. The Journal of general physiology. 2015 Feb;145(2):93-106.
Palovcak E, Delemotte L, Klein ML, Carnevale V. Comparative sequence analysis suggests a conserved gating mechanism for TRP channels. J Gen Physiol. 2015 Jul;146(1):37-50.   PMCID: 4485022
Paudyal S, Alfonso-Prieto M, Carnevale V, Redhu SK, Klein ML, Nicholson AW. Combined computational and experimental analysis of a complex of ribonuclease III and the regulatory macrodomain protein, YmdB. Proteins. 2015 Mar;83(3):459-72.   PMCID: PMC4329070
Remsing RC, McKendry IG, Strongin DR, Klein ML, Zdilla MJ. Frustrated Solvation Structures Can Enhance Electron Transfer Rates. The journal of physical chemistry letters. 2015 Dec 03;6(23):4804-8.
The above publications are sorted by year, faculty last name, and first author. Click on any highlighted author listed to find all publications attributed to that individual. Click on the publication title to see the abstract. First authors who are faculty are highlighted like this. Last authors who are faculty are highlighted like this. Other authors who are faculty are highlighted like this.

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Last updated on Friday, February 02, 2018