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Accelerated Lignocellulosic Molecule Adsorption Structure Determination.
J Chem Theory Comput. 2024 Mar 12;20(5):2297-2312. doi: 10.1021/acs.jctc.3c01292. Epub 2024 Feb 26.
J Chem Theory Comput. 2024.
PMID: 38408381
Free PMC article.
Elucidation of protein-ligand interactions by multiple trajectory analysis methods.
Wu N, Zhang R, Peng X, Fang L, Chen K, Jestilä JS.
Wu N, et al. Among authors: jestila js.
Phys Chem Chem Phys. 2024 Feb 22;26(8):6903-6915. doi: 10.1039/d3cp03492e.
Phys Chem Chem Phys. 2024.
PMID: 38334015
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The unimolecular dissociation of magnesium chloride squarate (ClMgC4O4-) and reductive cyclooligomerisation of CO on magnesium.
Jestilä JS, Iker Z, Ryding MJO, Uggerud E.
Jestilä JS, et al.
Org Biomol Chem. 2020 Dec 7;18(46):9499-9510. doi: 10.1039/d0ob01994a.
Org Biomol Chem. 2020.
PMID: 33185229
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Characterization of the alkali metal oxalates (MC2O4-) and their formation by CO2 reduction via the alkali metal carbonites (MCO2-).
Jestilä JS, Denton JK, Perez EH, Khuu T, Aprà E, Xantheas SS, Johnson MA, Uggerud E.
Jestilä JS, et al.
Phys Chem Chem Phys. 2020 Apr 8;22(14):7460-7473. doi: 10.1039/d0cp00547a.
Phys Chem Chem Phys. 2020.
PMID: 32219243
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Unimolecular Dissociation of Hydrogen Squarate (HC4O4-) and the Squarate Radical Anion (C4O4•-) in the Gas Phase and the Relationship to CO Cyclooligomerization.
Jestilä JS, Uggerud E.
Jestilä JS, et al.
J Org Chem. 2019 Nov 1;84(21):14005-14014. doi: 10.1021/acs.joc.9b02185. Epub 2019 Oct 23.
J Org Chem. 2019.
PMID: 31594310
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Unimolecular dissociation of anions derived from succinic acid (H2Su) in the gas phase: HSu- and ClMgSu-. Relationship to CO2 fixation.
Jestilä JS, Uggerud E.
Jestilä JS, et al.
Eur J Mass Spectrom (Chichester). 2018 Feb;24(1):33-42. doi: 10.1177/1469066717729904. Epub 2017 Sep 7.
Eur J Mass Spectrom (Chichester). 2018.
PMID: 29233005
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