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Page 1
An Assessment of Computational Methods for Calculating Accurate Structures and Energies of Bio-Relevant Polysulfur/Selenium-Containing Compounds.
Molecules. 2018 Dec 14;23(12):3323. doi: 10.3390/molecules23123323.
Molecules. 2018.
PMID: 30558190
Free PMC article.
Multiscale Computational Study on the Catalytic Mechanism of the Nonmetallo Amidase Maleamate Amidohydrolase (NicF).
Ion BF, Meister PJ, Gauld JW.
Ion BF, et al. Among authors: meister pj.
J Phys Chem A. 2019 Sep 12;123(36):7710-7719. doi: 10.1021/acs.jpca.9b05914. Epub 2019 Sep 3.
J Phys Chem A. 2019.
PMID: 31433182
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The K2(9-ethylguanine)122+ quadruplex is more stable to unimolecular dissociation than the K(9-ethylguanine)8+ quadruplex in the gas phase: a BIRD, energy resolved SORI-CID, IRMPD spectroscopic, and computational study.
Azargun M, Meister PJ, Gauld JW, Fridgen TD.
Azargun M, et al. Among authors: meister pj.
Phys Chem Chem Phys. 2019 Jul 17;21(28):15319-15326. doi: 10.1039/c9cp01651a.
Phys Chem Chem Phys. 2019.
PMID: 31243401
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