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

Year Number of Results
2002 1
2004 2
2005 4
2006 2
2007 8
2008 11
2009 7
2010 6
2011 7
2012 7
2013 8
2014 13
2015 17
2016 12
2017 12
2018 21
2019 10
2020 27
2021 25
2022 23
2023 24
2024 4

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244 results

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Page 1
Molecular dynamics on quantum annealers.
Gaidai I, Babikov D, Teplukhin A, Kendrick BK, Mniszewski SM, Zhang Y, Tretiak S, Dub PA. Gaidai I, et al. Among authors: tretiak s. Sci Rep. 2022 Oct 7;12(1):16824. doi: 10.1038/s41598-022-21163-x. Sci Rep. 2022. PMID: 36207401 Free PMC article.
NWChem: Recent and Ongoing Developments.
Mejia-Rodriguez D, Aprà E, Autschbach J, Bauman NP, Bylaska EJ, Govind N, Hammond JR, Kowalski K, Kunitsa A, Panyala A, Peng B, Rehr JJ, Song H, Tretiak S, Valiev M, Vila FD. Mejia-Rodriguez D, et al. Among authors: tretiak s. J Chem Theory Comput. 2023 Oct 24;19(20):7077-7096. doi: 10.1021/acs.jctc.3c00421. Epub 2023 Jul 17. J Chem Theory Comput. 2023. PMID: 37458314
Intermolecular conical intersections in molecular aggregates.
De Sio A, Sommer E, Nguyen XT, Groß L, Popović D, Nebgen BT, Fernandez-Alberti S, Pittalis S, Rozzi CA, Molinari E, Mena-Osteritz E, Bäuerle P, Frauenheim T, Tretiak S, Lienau C. De Sio A, et al. Among authors: tretiak s. Nat Nanotechnol. 2021 Jan;16(1):63-68. doi: 10.1038/s41565-020-00791-2. Epub 2020 Nov 16. Nat Nanotechnol. 2021. PMID: 33199882
Semi-Empirical Shadow Molecular Dynamics: A PyTorch Implementation.
Kulichenko M, Barros K, Lubbers N, Fedik N, Zhou G, Tretiak S, Nebgen B, Niklasson AMN. Kulichenko M, et al. Among authors: tretiak s. J Chem Theory Comput. 2023 Jun 13;19(11):3209-3222. doi: 10.1021/acs.jctc.3c00234. Epub 2023 May 10. J Chem Theory Comput. 2023. PMID: 37163680
Molecular dynamics study of plasmon-mediated chemical transformations.
Wu X, van der Heide T, Wen S, Frauenheim T, Tretiak S, Yam C, Zhang Y. Wu X, et al. Among authors: tretiak s. Chem Sci. 2023 Apr 8;14(18):4714-4723. doi: 10.1039/d2sc06648c. eCollection 2023 May 10. Chem Sci. 2023. PMID: 37181766 Free PMC article.
Plasmon mediated coherent population oscillations in molecular aggregates.
Timmer D, Gittinger M, Quenzel T, Stephan S, Zhang Y, Schumacher MF, Lützen A, Silies M, Tretiak S, Zhong JH, De Sio A, Lienau C. Timmer D, et al. Among authors: tretiak s. Nat Commun. 2023 Dec 5;14(1):8035. doi: 10.1038/s41467-023-43578-4. Nat Commun. 2023. PMID: 38052786 Free PMC article.
Partitioning Quantum Chemistry Simulations with Clifford Circuits.
Schleich P, Boen J, Cincio L, Anand A, Kottmann JS, Tretiak S, Dub PA, Aspuru-Guzik A. Schleich P, et al. Among authors: tretiak s. J Chem Theory Comput. 2023 Aug 8;19(15):4952-4964. doi: 10.1021/acs.jctc.3c00335. Epub 2023 Jul 25. J Chem Theory Comput. 2023. PMID: 37490516
244 results