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

Year Number of Results
2003 1
2005 1
2006 2
2007 3
2008 3
2009 3
2010 2
2011 11
2012 5
2013 10
2014 12
2015 14
2016 8
2017 11
2018 16
2019 24
2020 13
2021 16
2022 8
2023 14
2024 4

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171 results

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Page 1
Markov Models of Molecular Kinetics.
Noé F, Rosta E. Noé F, et al. J Chem Phys. 2019 Nov 21;151(19):190401. doi: 10.1063/1.5134029. J Chem Phys. 2019. PMID: 31757166 No abstract available.
Uncertainty estimation.
Noé F, Chodera JD. Noé F, et al. Adv Exp Med Biol. 2014;797:61-74. doi: 10.1007/978-94-007-7606-7_5. Adv Exp Med Biol. 2014. PMID: 24297275 No abstract available.
Machine learning for protein folding and dynamics.
Noé F, De Fabritiis G, Clementi C. Noé F, et al. Curr Opin Struct Biol. 2020 Feb;60:77-84. doi: 10.1016/j.sbi.2019.12.005. Epub 2019 Dec 24. Curr Opin Struct Biol. 2020. PMID: 31881449 Review.
Ab initio quantum chemistry with neural-network wavefunctions.
Hermann J, Spencer J, Choo K, Mezzacapo A, Foulkes WMC, Pfau D, Carleo G, Noé F. Hermann J, et al. Among authors: noe f. Nat Rev Chem. 2023 Oct;7(10):692-709. doi: 10.1038/s41570-023-00516-8. Epub 2023 Aug 9. Nat Rev Chem. 2023. PMID: 37558761 Review.
MHC-II dynamics are maintained in HLA-DR allotypes to ensure catalyzed peptide exchange.
Abualrous ET, Stolzenberg S, Sticht J, Wieczorek M, Roske Y, Günther M, Dähn S, Boesen BB, Calvo MM, Biese C, Kuppler F, Medina-García Á, Álvaro-Benito M, Höfer T, Noé F, Freund C. Abualrous ET, et al. Among authors: noe f. Nat Chem Biol. 2023 Oct;19(10):1196-1204. doi: 10.1038/s41589-023-01316-3. Epub 2023 May 4. Nat Chem Biol. 2023. PMID: 37142807 Free PMC article.
Machine learned coarse-grained protein force-fields: Are we there yet?
Durumeric AEP, Charron NE, Templeton C, Musil F, Bonneau K, Pasos-Trejo AS, Chen Y, Kelkar A, Noé F, Clementi C. Durumeric AEP, et al. Among authors: noe f. Curr Opin Struct Biol. 2023 Apr;79:102533. doi: 10.1016/j.sbi.2023.102533. Epub 2023 Jan 31. Curr Opin Struct Biol. 2023. PMID: 36731338 Free PMC article. Review.
Quantum dynamics using path integral coarse-graining.
Musil F, Zaporozhets I, Noé F, Clementi C, Kapil V. Musil F, et al. Among authors: noe f. J Chem Phys. 2022 Nov 14;157(18):181102. doi: 10.1063/5.0120386. J Chem Phys. 2022. PMID: 36379765
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… See abstract for full author list ➔ Schimunek J, et al. Among authors: noe f. Mol Inform. 2024 Jan;43(1):e202300262. doi: 10.1002/minf.202300262. Epub 2023 Nov 14. Mol Inform. 2024. PMID: 37833243
Estimation and validation of Markov models.
Prinz JH, Chodera JD, Noé F. Prinz JH, et al. Among authors: noe f. Adv Exp Med Biol. 2014;797:45-60. doi: 10.1007/978-94-007-7606-7_4. Adv Exp Med Biol. 2014. PMID: 24297274 Review. No abstract available.
171 results