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Molecular mechanics.
Vanommeslaeghe K, Guvench O, MacKerell AD Jr. Vanommeslaeghe K, et al. Curr Pharm Des. 2014;20(20):3281-92. doi: 10.2174/13816128113199990600. Curr Pharm Des. 2014. PMID: 23947650 Free PMC article. Review.
Editorial: Advances in computational molecular biophysics.
Baudry J, Bondar AN, Cournia Z, Parks JM, Petridis L, Roux B. Baudry J, et al. Biochim Biophys Acta Gen Subj. 2021 Jun;1865(6):129888. doi: 10.1016/j.bbagen.2021.129888. Epub 2021 Mar 2. Biochim Biophys Acta Gen Subj. 2021. PMID: 33662454 No abstract available.
CHARMM-GUI 10 years for biomolecular modeling and simulation.
Jo S, Cheng X, Lee J, Kim S, Park SJ, Patel DS, Beaven AH, Lee KI, Rui H, Park S, Lee HS, Roux B, MacKerell AD Jr, Klauda JB, Qi Y, Im W. Jo S, et al. J Comput Chem. 2017 Jun 5;38(15):1114-1124. doi: 10.1002/jcc.24660. Epub 2016 Nov 14. J Comput Chem. 2017. PMID: 27862047 Free PMC article. Review.
108 results