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Recent Efforts and Milestones for Simulating Nucleic Acid FRET Experiments through Computational Methods.
J Chem Inf Model. 2022 Jan 24;62(2):232-239. doi: 10.1021/acs.jcim.1c00957. Epub 2022 Jan 11.
J Chem Inf Model. 2022.
PMID: 35014791
Review.
Community assessment to advance computational prediction of cancer drug combinations in a pharmacogenomic screen.
Menden MP, Wang D, Mason MJ, Szalai B, Bulusu KC, Guan Y, Yu T, Kang J, Jeon M, Wolfinger R, Nguyen T, Zaslavskiy M; AstraZeneca-Sanger Drug Combination DREAM Consortium; Jang IS, Ghazoui Z, Ahsen ME, Vogel R, Neto EC, Norman T, Tang EKY, Garnett MJ, Veroli GYD, Fawell S, Stolovitzky G, Guinney J, Dry JR, Saez-Rodriguez J.
Menden MP, et al.
Nat Commun. 2019 Jun 17;10(1):2674. doi: 10.1038/s41467-019-09799-2.
Nat Commun. 2019.
PMID: 31209238
Free PMC article.
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Towards Performant Design of Carbon-Based Nanomotors for Hydrogen Separation through Molecular Dynamics Simulations.
Muraru S, Ionita M.
Muraru S, et al.
Int J Mol Sci. 2020 Dec 16;21(24):9588. doi: 10.3390/ijms21249588.
Int J Mol Sci. 2020.
PMID: 33339237
Free PMC article.
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