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Multiscale Workflow for Modeling Ligand Complexes of Zinc Metalloproteins.
Yang Z, Twidale RM, Gervasoni S, Suardíaz R, Colenso CK, Lang EJM, Spencer J, Mulholland AJ. Yang Z, et al. Among authors: colenso ck. J Chem Inf Model. 2021 Nov 22;61(11):5658-5672. doi: 10.1021/acs.jcim.1c01109. Epub 2021 Nov 8. J Chem Inf Model. 2021. PMID: 34748329
Molecular Simulations suggest Vitamins, Retinoids and Steroids as Ligands of the Free Fatty Acid Pocket of the SARS-CoV-2 Spike Protein*.
Shoemark DK, Colenso CK, Toelzer C, Gupta K, Sessions RB, Davidson AD, Berger I, Schaffitzel C, Spencer J, Mulholland AJ. Shoemark DK, et al. Among authors: colenso ck. Angew Chem Int Ed Engl. 2021 Mar 22;60(13):7098-7110. doi: 10.1002/anie.202015639. Epub 2021 Feb 22. Angew Chem Int Ed Engl. 2021. PMID: 33469977 Free PMC article.
Frontispiz: Molecular Simulations suggest Vitamins, Retinoids and Steroids as Ligands of the Free Fatty Acid Pocket of the SARS-CoV-2 Spike Protein.
Shoemark DK, Colenso CK, Toelzer C, Gupta K, Sessions RB, Davidson AD, Berger I, Schaffitzel C, Spencer J, Mulholland AJ. Shoemark DK, et al. Among authors: colenso ck. Angew Chem Weinheim Bergstr Ger. 2021 Mar 22;133(13):10.1002/ange.202181362. doi: 10.1002/ange.202181362. Epub 2021 Mar 15. Angew Chem Weinheim Bergstr Ger. 2021. PMID: 34230706 Free PMC article.
β-Lactamases and β-Lactamase Inhibitors in the 21st Century.
Tooke CL, Hinchliffe P, Bragginton EC, Colenso CK, Hirvonen VHA, Takebayashi Y, Spencer J. Tooke CL, et al. Among authors: colenso ck. J Mol Biol. 2019 Aug 23;431(18):3472-3500. doi: 10.1016/j.jmb.2019.04.002. Epub 2019 Apr 5. J Mol Biol. 2019. PMID: 30959050 Free PMC article. Review.
The hERG K(+) channel S4 domain L532P mutation: characterization at 37°C.
Zhang YH, Colenso CK, Sessions RB, Dempsey CE, Hancox JC. Zhang YH, et al. Among authors: colenso ck. Biochim Biophys Acta. 2011 Oct;1808(10):2477-87. doi: 10.1016/j.bbamem.2011.07.001. Epub 2011 Jul 14. Biochim Biophys Acta. 2011. PMID: 21777565 Free PMC article.
16 results