Martini 3 Coarse-Grained Force Field for Carbohydrates

Fabian Grünewald; Mats H. Punt; Elizabeth E. Jefferys; Petteri Vainikka; Melanie König; Valtteri Virtanen; Travis A. Meyer; Weria Pezeshkian; Adam Gormley; Maarit Karonen; Mark S. P. Sansom; Paulo C. T. Souza; Siewert Marrink

doi:10.1021/acs.jctc.2c00757

Martini 3 Coarse-Grained Force Field for Carbohydrates

Fabian Grünewald, Mats H. Punt, Elizabeth E. Jefferys, Petteri Vainikka, Melanie König, Valtteri Virtanen, Travis A. Meyer, Weria Pezeshkian, Adam Gormley, Maarit Karonen, Mark S. P. Sansom, Paulo C. T. Souza, Siewert Marrink

Niels Bohr International Academy

Research output: Contribution to journal › Journal article › Research › peer-review

22 Citations (Scopus)

11 Downloads (Pure)

Original language	English
Journal	Journal of Chemical Theory and Computation
Volume	18
Issue number	12
Pages (from-to)	7555-7569
Number of pages	15
ISSN	1549-9618
DOIs	https://doi.org/10.1021/acs.jctc.2c00757
Publication status	Published - 7 Nov 2022

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Martini 3 Coarse-Grained Force Field for Carbohydrates. / Grünewald, Fabian; Punt, Mats H.; Jefferys, Elizabeth E.; Vainikka, Petteri; König, Melanie; Virtanen, Valtteri; Meyer, Travis A.; Pezeshkian, Weria; Gormley, Adam; Karonen, Maarit; Sansom, Mark S. P.; Souza, Paulo C. T.; Marrink, Siewert.

In: Journal of Chemical Theory and Computation, Vol. 18, No. 12, 07.11.2022, p. 7555-7569.

Research output: Contribution to journal › Journal article › Research › peer-review

Grünewald, Fabian ; Punt, Mats H. ; Jefferys, Elizabeth E. ; Vainikka, Petteri ; König, Melanie ; Virtanen, Valtteri ; Meyer, Travis A. ; Pezeshkian, Weria ; Gormley, Adam ; Karonen, Maarit ; Sansom, Mark S. P. ; Souza, Paulo C. T. ; Marrink, Siewert. / Martini 3 Coarse-Grained Force Field for Carbohydrates. In: Journal of Chemical Theory and Computation. 2022 ; Vol. 18, No. 12. pp. 7555-7569.

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AU - Virtanen, Valtteri

AU - Meyer, Travis A.

AU - Pezeshkian, Weria

AU - Gormley, Adam

AU - Karonen, Maarit

AU - Sansom, Mark S. P.

AU - Souza, Paulo C. T.

AU - Marrink, Siewert

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