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Page 1
Bottom-up Coarse-Graining: Principles and Perspectives.
Jin J, Pak AJ, Durumeric AEP, Loose TD, Voth GA. Jin J, et al. Among authors: pak aj. J Chem Theory Comput. 2022 Oct 11;18(10):5759-5791. doi: 10.1021/acs.jctc.2c00643. Epub 2022 Sep 7. J Chem Theory Comput. 2022. PMID: 36070494 Free PMC article. Review.
OpenMSCG: A Software Tool for Bottom-Up Coarse-Graining.
Peng Y, Pak AJ, Durumeric AEP, Sahrmann PG, Mani S, Jin J, Loose TD, Beiter J, Voth GA. Peng Y, et al. Among authors: pak aj. J Phys Chem B. 2023 Oct 12;127(40):8537-8550. doi: 10.1021/acs.jpcb.3c04473. Epub 2023 Oct 4. J Phys Chem B. 2023. PMID: 37791670 Free PMC article.
A multiscale coarse-grained model of the SARS-CoV-2 virion.
Yu A, Pak AJ, He P, Monje-Galvan V, Casalino L, Gaieb Z, Dommer AC, Amaro RE, Voth GA. Yu A, et al. Among authors: pak aj. Biophys J. 2021 Mar 16;120(6):1097-1104. doi: 10.1016/j.bpj.2020.10.048. Epub 2020 Nov 28. Biophys J. 2021. PMID: 33253634 Free PMC article.
32 results