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N-type organic thermoelectrics: demonstration of ZT > 0.3.
Liu J, van der Zee B, Alessandri R, Sami S, Dong J, Nugraha MI, Barker AJ, Rousseva S, Qiu L, Qiu X, Klasen N, Chiechi RC, Baran D, Caironi M, Anthopoulos TD, Portale G, Havenith RWA, Marrink SJ, Hummelen JC, Koster LJA. Liu J, et al. Among authors: marrink sj. Nat Commun. 2020 Nov 10;11(1):5694. doi: 10.1038/s41467-020-19537-8. Nat Commun. 2020. PMID: 33173050 Free PMC article.
Pitfalls of the Martini Model.
Alessandri R, Souza PCT, Thallmair S, Melo MN, de Vries AH, Marrink SJ. Alessandri R, et al. Among authors: marrink sj. J Chem Theory Comput. 2019 Oct 8;15(10):5448-5460. doi: 10.1021/acs.jctc.9b00473. Epub 2019 Sep 24. J Chem Theory Comput. 2019. PMID: 31498621 Free PMC article.
Protein-ligand binding with the coarse-grained Martini model.
Souza PCT, Thallmair S, Conflitti P, Ramírez-Palacios C, Alessandri R, Raniolo S, Limongelli V, Marrink SJ. Souza PCT, et al. Among authors: marrink sj. Nat Commun. 2020 Jul 24;11(1):3714. doi: 10.1038/s41467-020-17437-5. Nat Commun. 2020. PMID: 32709852 Free PMC article.
285 results