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Mapping structural and dynamic divergence across the MBOAT family.
Ansell TB, Healy M, Coupland CE, Sansom MSP, Siebold C. Ansell TB, et al. Among authors: sansom msp. Structure. 2024 Jul 11;32(7):1011-1022.e3. doi: 10.1016/j.str.2024.03.014. Epub 2024 Apr 17. Structure. 2024. PMID: 38636523 Free article.
Martini 3 Coarse-Grained Force Field for Carbohydrates.
Grünewald F, Punt MH, Jefferys EE, Vainikka PA, König M, Virtanen V, Meyer TA, Pezeshkian W, Gormley AJ, Karonen M, Sansom MSP, Souza PCT, Marrink SJ. Grünewald F, et al. Among authors: sansom msp. J Chem Theory Comput. 2022 Dec 13;18(12):7555-7569. doi: 10.1021/acs.jctc.2c00757. Epub 2022 Nov 7. J Chem Theory Comput. 2022. PMID: 36342474 Free PMC article.
Functional dynamics of G protein-coupled receptors reveal new routes for drug discovery.
Conflitti P, Lyman E, Sansom MSP, Hildebrand PW, Gutiérrez-de-Terán H, Carloni P, Ansell TB, Yuan S, Barth P, Robinson AS, Tate CG, Gloriam D, Grzesiek S, Eddy MT, Prosser S, Limongelli V. Conflitti P, et al. Among authors: sansom msp. Nat Rev Drug Discov. 2025 Jan 2. doi: 10.1038/s41573-024-01083-3. Online ahead of print. Nat Rev Drug Discov. 2025. PMID: 39747671 Review.
The Role of Cholesterol in M2 Clustering and Viral Budding Explained.
Kolokouris D, Kalenderoglou IE, Duncan AL, Corey RA, Sansom MSP, Kolocouris A. Kolokouris D, et al. Among authors: sansom msp. J Chem Theory Comput. 2024 Nov 4. doi: 10.1021/acs.jctc.4c01026. Online ahead of print. J Chem Theory Comput. 2024. PMID: 39494590
394 results