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

Year Number of Results
1984 1
1985 1
1986 18
1992 1
1993 1
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1999 21
2001 12
2002 164
2003 201
2004 198
2005 169
2006 179
2007 253
2008 267
2009 261
2010 380
2011 412
2012 356
2013 325
2014 271
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2017 340
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2026 71

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Page 1
Editorial Note.
Frenking G. Frenking G. J Comput Chem. 2025 Mar 30;46(8):e70068. doi: 10.1002/jcc.70068. J Comput Chem. 2025. PMID: 40155197 No abstract available.
Fast vibrational analysis of molecular systems.
Petitjean H, Giard A, Flament JP, Berthomieu C, Berthomieu D. Petitjean H, et al. J Comput Chem. 2024 Oct 30;45(28):2374-2382. doi: 10.1002/jcc.27450. Epub 2024 Jun 22. J Comput Chem. 2024. PMID: 39222372 Review.
The Mechanism of Nitrite Reductase.
Siegbahn PEM. Siegbahn PEM. J Comput Chem. 2025 Mar 30;46(8):e70088. doi: 10.1002/jcc.70088. J Comput Chem. 2025. PMID: 40127040 Free PMC article.
Deep reinforcement learning in chemistry: A review.
Sridharan B, Sinha A, Bardhan J, Modee R, Ehara M, Priyakumar UD. Sridharan B, et al. J Comput Chem. 2024 Aug 15;45(22):1886-1898. doi: 10.1002/jcc.27354. Epub 2024 May 2. J Comput Chem. 2024. PMID: 38698628 Review.
Preface of Carlo Adamo's virtual special issue.
Brémond É, Ciofini I, Labat F, Tognetti V. Brémond É, et al. J Comput Chem. 2024 Sep 30;45(25):2110-2111. doi: 10.1002/jcc.27462. Epub 2024 Jul 9. J Comput Chem. 2024. PMID: 38979958 No abstract available.
Not Just Another Crystal Field Software.
Fiorucci L, Ravera E. Fiorucci L, et al. J Comput Chem. 2025 Mar 5;46(6):e70063. doi: 10.1002/jcc.70063. J Comput Chem. 2025. PMID: 40029752 Free PMC article.
LOPOSTER: A Cascading Postprocessor for LOBSTER.
Wang Y, Müller PC, Hemker D, Dronskowski R. Wang Y, et al. J Comput Chem. 2025 Jun 30;46(17):e70167. doi: 10.1002/jcc.70167. J Comput Chem. 2025. PMID: 40586640 Free PMC article.
Foreword to the special issue for Elfi Kraka.
Aquino A, Lischka H, Frenking G. Aquino A, et al. J Comput Chem. 2024 Jul 15;45(19):1642. doi: 10.1002/jcc.27316. Epub 2024 Mar 28. J Comput Chem. 2024. PMID: 38545736 No abstract available.
5,896 results