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The Role of the CuCl Active Complex in the Stereoselectivity of the Salt-Induced Peptide Formation Reaction: Insights from Density Functional Theory Calculations.
Life (Basel). 2023 Aug 23;13(9):1796. doi: 10.3390/life13091796.
Life (Basel). 2023.
PMID: 37763200
Free PMC article.
Microbial Denitrification: Active Site and Reaction Path Models Predict New Isotopic Fingerprints.
Boettger JD, Neubauer C, Kopf SH, Kubicki JD.
Boettger JD, et al.
ACS Earth Space Chem. 2022 Nov 17;6(11):2582-2594. doi: 10.1021/acsearthspacechem.2c00102. Epub 2022 Oct 20.
ACS Earth Space Chem. 2022.
PMID: 36425342
Free PMC article.
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Evaluating Computational Chemistry Methods for Isotopic Fractionation between CO2(g) and H2O(g).
Boettger JD, Kubicki JD.
Boettger JD, et al.
J Chem Inf Model. 2019 Nov 25;59(11):4663-4677. doi: 10.1021/acs.jcim.9b00392. Epub 2019 Nov 12.
J Chem Inf Model. 2019.
PMID: 31689097
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