Lynn Kamerlin

Computational Chemistry

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2026
Mark The borderlands of foldability : lessons from simplified proteins
Seya, Koh ; Brownless, Alfie Louise R. ; Kamerlin, Shina C.L. ^LU and Longo, Liam M. (2026) In Trends in Chemistry 8(5). p.362-376
- Contribution to journal › Scientific review
Mark Conformational Dynamics and Catalytic Backups in a Hyper-thermostable Engineered Archaeal Protein Tyrosine Phosphatase
Yehorova, Dariia ; Alansson, Nikolas ; Shen, Ruidan ; Denson, Joshua M. ; Robinson, Michael ; Risso, Valeria A. ; Ramirez Molina, Nuria ; Loria, J. Patrick ; Gaucher, Eric A. and Sanchez-Ruiz, Jose M. , et al. (2026) In JACS Au 6(1). p.59-81
- Contribution to journal › Article
Mark Myosin Post-Translational Modifications Associated With Critical Illness Myopathy
Ribeiro, Fernando ; Di Geronimo, Bruno ; Cacciani, Nicola ; Widgren, Anna ; Hedström, Yvette ; Moriscot, Anselmo S. ; Kasson, Peter M. ; Kamerlin, Shina C.L. ^LU ; Bergquist, Jonas and Larsson, Lars (2026) In Acta Physiologica 242(7).
- Contribution to journal › Article
Mark Loop dynamics, allostery, and function in protein tyrosine phosphatases : insights from molecular simulations
Welsh, Colin L. and Kamerlin, Shina Caroline Lynn ^LU (2026) In Biochemical Society Transactions 54(1). p.1-12
- Contribution to journal › Scientific review
2025
Mark WatCon : A Python Tool for Analysis of Conserved Water Networks Across Protein Families
Brownless, Alfie Louise R. ; Harrison-Rawn, Travis and Kamerlin, Shina C.L. ^LU (2025) In JACS Au 5(12). p.6379-6395
- Contribution to journal › Article
Mark Redefining the Limits of Functional Continuity in the Early Evolution of P-Loop NTPases
Demkiv, Andrey O. ; Toledo-Patiño, Saacnicteh ; Medina-Carmona, Encarnación ; Berg, Andrej ; Pinto, Gaspar P. ; Parracino, Antonietta ; Sanchez-Ruiz, Jose M. ; Hengge, Alvan C. ; Laurino, Paola and Longo, Liam M. , et al. (2025) In Molecular biology and evolution 42(4).
- Contribution to journal › Article
Mark Mechanistic Elucidation and Stereochemical Consequences of Alternative Binding of Alkenyl Substrates by Engineered Arylmalonate Decarboxylase
van der Pol, Elske ; Schlatzer, Thomas ; Hoffka, Gyula ^LU ; Di Geronimo, Bruno ; Eder, Johannes ; Schweiger, Anna K. ; Karava, Marianna ; Gross, Dominik ; Fischer, Roland C. and Kracher, Daniel , et al. (2025) In Journal of the American Chemical Society 147(43). p.39271-39283
- Contribution to journal › Article
Mark Generative AI techniques for conformational diversity and evolutionary adaptation of proteins
Brownless, Alfie Louise R. ; Yehorova, Dariia ; Welsh, Colin L. and Kamerlin, Shina Caroline Lynn ^LU (2025) In Current Opinion in Structural Biology 94.
- Contribution to journal › Scientific review
Mark Complete computational design of high-efficiency Kemp elimination enzymes
Listov, Dina ; Vos, Eva ; Hoffka, Gyula ^LU ; Hoch, Shlomo Yakir ; Berg, Andrej ; Hamer-Rogotner, Shelly ; Dym, Orly ; Kamerlin, Shina Caroline Lynn ^LU and Fleishman, Sarel J. (2025) In Nature 643(8074). p.1421-1427
- Contribution to journal › Article
Mark Targeting MarA N-terminal domain dynamics to prevent DNA binding
Corbella, Marina ; Moreira, Cátia ; Bello-Madruga, Roberto ; Torrent Burgas, Marc ; Kamerlin, Shina C L ^LU ; Blair, Jessica M A and Sancho-Vaello, Enea (2025) In Protein Science 34(1).
- Contribution to journal › Article

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