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Table representation of search results timeline featuring number of search results per year.

Year Number of Results
2002 6
2003 5
2004 13
2005 15
2006 11
2007 16
2008 18
2009 17
2010 19
2011 25
2012 25
2013 32
2014 18
2015 30
2016 26
2017 20
2018 17
2019 17
2020 20
2021 20
2022 14
2023 14
2024 1

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364 results

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Page 1
Computer-Aided Drug Design Methods.
Yu W, MacKerell AD Jr. Yu W, et al. Among authors: mackerell ad jr. Methods Mol Biol. 2017;1520:85-106. doi: 10.1007/978-1-4939-6634-9_5. Methods Mol Biol. 2017. PMID: 27873247 Free PMC article.
Molecular mechanics.
Vanommeslaeghe K, Guvench O, MacKerell AD Jr. Vanommeslaeghe K, et al. Among authors: mackerell ad jr. Curr Pharm Des. 2014;20(20):3281-92. doi: 10.2174/13816128113199990600. Curr Pharm Des. 2014. PMID: 23947650 Free PMC article. Review.
Biomolecular dynamics in the 21st century.
Brooks CL 3rd, MacKerell AD Jr, Post CB, Nilsson L. Brooks CL 3rd, et al. Among authors: mackerell ad jr. Biochim Biophys Acta Gen Subj. 2024 Feb;1868(2):130534. doi: 10.1016/j.bbagen.2023.130534. Epub 2023 Dec 6. Biochim Biophys Acta Gen Subj. 2024. PMID: 38065235 Free article. Review.
Computer-Aided Drug Design: An Update.
Yu W, Weber DJ, MacKerell AD Jr. Yu W, et al. Among authors: mackerell ad jr. Methods Mol Biol. 2023;2601:123-152. doi: 10.1007/978-1-0716-2855-3_7. Methods Mol Biol. 2023. PMID: 36445582 Free PMC article.
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. Among authors: mackerell ad jr. 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.
Preserving the Integrity of Empirical Force Fields.
Orr AA, Sharif S, Wang J, MacKerell AD Jr. Orr AA, et al. Among authors: mackerell ad jr. J Chem Inf Model. 2022 Aug 22;62(16):3825-3831. doi: 10.1021/acs.jcim.2c00615. Epub 2022 Aug 2. J Chem Inf Model. 2022. PMID: 35917398 Free PMC article.
Dendritic Cell-Mediated Cross-Priming by a Bispecific Neutralizing Antibody Boosts Cytotoxic T Cell Responses and Protects Mice against SARS-CoV-2.
Lázaro-Gorines R, Pérez P, Heras-Murillo I, Adán-Barrientos I, Albericio G, Astorgano D, Flores S, Luczkowiak J, Labiod N, Harwood SL, Segura-Tudela A, Rubio-Pérez L, Nugraha Y, Shang X, Li Y, Alfonso C, Adipietro KA, Abeyawardhane DL, Navarro R, Compte M, Yu W, MacKerell AD Jr, Sanz L, Weber DJ, Blanco FJ, Esteban M, Pozharski E, Godoy-Ruiz R, Muñoz IG, Delgado R, Sancho D, García-Arriaza J, Álvarez-Vallina L. Lázaro-Gorines R, et al. Among authors: mackerell ad jr. Adv Sci (Weinh). 2023 Dec;10(34):e2304818. doi: 10.1002/advs.202304818. Epub 2023 Oct 20. Adv Sci (Weinh). 2023. PMID: 37863812 Free PMC article.
Design of Inhibitors for S100B.
Markowitz J, Mackerell AD Jr, Carrier F, Charpentier TH, Weber DJ. Markowitz J, et al. Among authors: mackerell ad jr. Curr Top Med Chem. 2005;5(12):1093-108. doi: 10.2174/156802605774370865. Curr Top Med Chem. 2005. PMID: 16248785 Review.
364 results