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

Year Number of Results
1985 2
1986 1
1988 1
1989 2
1990 3
1991 3
1992 2
1993 2
1994 2
1995 4
1996 3
1997 4
1998 6
1999 3
2000 1
2001 5
2002 12
2003 13
2004 22
2005 16
2006 12
2007 15
2008 14
2009 13
2010 9
2011 18
2012 14
2013 19
2014 20
2015 19
2016 13
2017 9
2018 9
2019 10
2020 5
2021 8
2022 6
2023 7
2024 5

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313 results

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Page 1
Classical molecular dynamics.
Brooks CL 3rd, Case DA, Plimpton S, Roux B, van der Spoel D, Tajkhorshid E. Brooks CL 3rd, et al. J Chem Phys. 2021 Mar 14;154(10):100401. doi: 10.1063/5.0045455. J Chem Phys. 2021. PMID: 33722022 No abstract available.
Editorial.
Post CB, Brooks CL 3rd. Post CB, et al. Among authors: brooks cl 3rd. Protein Sci. 2016 Jan;25(1):5-8. doi: 10.1002/pro.2851. Protein Sci. 2016. PMID: 26735111 Free PMC article. No abstract available.
Biomolecular dynamics in the 21st century.
Brooks CL 3rd, MacKerell AD Jr, Post CB, Nilsson L. Brooks CL 3rd, et al. 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.
Free Gangliosides Can Alter Amyloid-β Aggregation.
Chakravorty A, McCalpin SD, Sahoo BR, Ramamoorthy A, Brooks CL 3rd. Chakravorty A, et al. Among authors: brooks cl 3rd. J Phys Chem Lett. 2022 Oct 13;13(40):9303-9308. doi: 10.1021/acs.jpclett.2c02362. Epub 2022 Sep 29. J Phys Chem Lett. 2022. PMID: 36174129 Free PMC article.
A community effort in SARS-CoV-2 drug discovery.
Schimunek J, Seidl P, Elez K, Hempel T, Le T, Noé F, Olsson S, Raich L, Winter R, Gokcan H, Gusev F, Gutkin EM, Isayev O, Kurnikova MG, Narangoda CH, Zubatyuk R, Bosko IP, Furs KV, Karpenko AD, Kornoushenko YV, Shuldau M, Yushkevich A, Benabderrahmane MB, Bousquet-Melou P, Bureau R, Charton B, Cirou BC, Gil G, Allen WJ, Sirimulla S, Watowich S, Antonopoulos N, Epitropakis N, Krasoulis A, Itsikalis V, Theodorakis S, Kozlovskii I, Maliutin A, Medvedev A, Popov P, Zaretckii M, Eghbal-Zadeh H, Halmich C, Hochreiter S, Mayr A, Ruch P, Widrich M, Berenger F, Kumar A, Yamanishi Y, Zhang KYJ, Bengio E, Bengio Y, Jain MJ, Korablyov M, Liu CH, Marcou G, Glaab E, Barnsley K, Iyengar SM, Ondrechen MJ, Haupt VJ, Kaiser F, Schroeder M, Pugliese L, Albani S, Athanasiou C, Beccari A, Carloni P, D'Arrigo G, Gianquinto E, Goßen J, Hanke A, Joseph BP, Kokh DB, Kovachka S, Manelfi C, Mukherjee G, Muñiz-Chicharro A, Musiani F, Nunes-Alves A, Paiardi G, Rossetti G, Sadiq SK, Spyrakis F, Talarico C, Tsengenes A, Wade RC, Copeland C, Gaiser J, Olson DR, Roy A, Venkatraman V, Wheeler TJ, Arthanari H, Blaschitz K, Cespugli M, Durmaz V, Fackeldey K, Fischer PD, Gorgulla C, Gruber C, Gruber K, Hetmann M, Kin… See abstract for full author list ➔ Schimunek J, et al. Among authors: brooks cl 3rd. Mol Inform. 2024 Jan;43(1):e202300262. doi: 10.1002/minf.202300262. Epub 2023 Nov 14. Mol Inform. 2024. PMID: 37833243
Biocatalytic Stereoselective Oxidation of 2-Arylindoles.
Champagne SE, Chiang CH, Gemmel PM, Brooks CL 3rd, Narayan ARH. Champagne SE, et al. Among authors: brooks cl 3rd. J Am Chem Soc. 2024 Jan 31;146(4):2728-2735. doi: 10.1021/jacs.3c12393. Epub 2024 Jan 18. J Am Chem Soc. 2024. PMID: 38237569
New paint and a new engine.
Brooks CL 3rd, Ehara M, Frenking G, Schreiner PR. Brooks CL 3rd, et al. J Comput Chem. 2013 Jan 5;34(1):1. doi: 10.1002/jcc.23187. J Comput Chem. 2013. PMID: 23180395 Free article. No abstract available.
Positioning-Group-Enabled Biocatalytic Oxidative Dearomatization.
Dockrey SAB, Suh CE, Benítez AR, Wymore T, Brooks CL 3rd, Narayan ARH. Dockrey SAB, et al. Among authors: brooks cl 3rd. ACS Cent Sci. 2019 Jun 26;5(6):1010-1016. doi: 10.1021/acscentsci.9b00163. Epub 2019 Jun 12. ACS Cent Sci. 2019. PMID: 31263760 Free PMC article.
CHARMM: the biomolecular simulation program.
Brooks BR, Brooks CL 3rd, Mackerell AD Jr, Nilsson L, Petrella RJ, Roux B, Won Y, Archontis G, Bartels C, Boresch S, Caflisch A, Caves L, Cui Q, Dinner AR, Feig M, Fischer S, Gao J, Hodoscek M, Im W, Kuczera K, Lazaridis T, Ma J, Ovchinnikov V, Paci E, Pastor RW, Post CB, Pu JZ, Schaefer M, Tidor B, Venable RM, Woodcock HL, Wu X, Yang W, York DM, Karplus M. Brooks BR, et al. Among authors: brooks cl 3rd. J Comput Chem. 2009 Jul 30;30(10):1545-614. doi: 10.1002/jcc.21287. J Comput Chem. 2009. PMID: 19444816 Free PMC article. Review.
Optimizing Multisite λ-Dynamics Throughput with Charge Renormalization.
Vilseck JZ, Cervantes LF, Hayes RL, Brooks CL 3rd. Vilseck JZ, et al. Among authors: brooks cl 3rd. J Chem Inf Model. 2022 Mar 28;62(6):1479-1488. doi: 10.1021/acs.jcim.2c00047. Epub 2022 Mar 14. J Chem Inf Model. 2022. PMID: 35286093 Free PMC article.
313 results