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2,8-Disubstituted-1,5-naphthyridines as Dual Inhibitors of Plasmodium falciparum Phosphatidylinositol-4-kinase and Hemozoin Formation with In Vivo Efficacy.
J Med Chem. 2024 Jul 11;67(13):11401-11420. doi: 10.1021/acs.jmedchem.4c01154. Epub 2024 Jun 25.
J Med Chem. 2024.
PMID: 38918002
Free PMC article.
Exhaustive computational search of ionic-charge clusters that mediate interactions between mammalian cytochrome P450 (CYP) and P450-oxidoreductase (POR) proteins.
Zawaira A, Gallotta M, Beeton-Kempen N, Coulson L, Marais P, Kuttel M, Blackburn J.
Zawaira A, et al.
Comput Biol Chem. 2010 Feb;34(1):42-52. doi: 10.1016/j.compbiolchem.2009.10.006. Epub 2009 Oct 31.
Comput Biol Chem. 2010.
PMID: 19939736
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On the deduction and analysis of singlet and two-state gating-models from the static structures of mammalian CYP450.
Zawaira A, Coulson L, Gallotta M, Karimanzira O, Blackburn J.
Zawaira A, et al.
J Struct Biol. 2011 Feb;173(2):282-93. doi: 10.1016/j.jsb.2010.09.026. Epub 2010 Oct 12.
J Struct Biol. 2011.
PMID: 20932908
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Revisiting the Plasmodium falciparum druggable genome using predicted structures and data mining.
Godinez-Macias KP, Chen D, Wallis JL, Siegel MG, Adam A, Bopp S, Carolino K, Coulson LB, Durst G, Thathy V, Esherick L, Farringer MA, Flannery EL, Forte B, Liu T, Magalhaes LG, Gupta AK, Istvan ES, Jiang T, Kumpornsin K, Lobb K, McLean K, Moura IMR, Okombo J, Payne NC, Plater A, Rao SPS, Siqueira-Neto JL, Somsen BA, Summers RL, Zhang R, Gilson MK, Gamo FJ, Campo B, Baragaña B, Duffy J, Gilbert IH, Lukens AK, Dechering KJ, Niles JC, McNamara CW, Cheng X, Birkholtz LM, Bronkhorst AW, Fidock DA, Wirth DF, Goldberg DE, Lee MCS, Winzeler EA.
Godinez-Macias KP, et al. Among authors: coulson lb.
Res Sq [Preprint]. 2024 Nov 26:rs.3.rs-5412515. doi: 10.21203/rs.3.rs-5412515/v1.
Res Sq. 2024.
PMID: 39649165
Free PMC article.
Preprint.
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