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Water-soluble loratadine inclusion complex: analytical control of the preparation by microwave irradiation.
J Pharm Biomed Anal. 2008 Nov 4;48(3):1020-3. doi: 10.1016/j.jpba.2008.07.001. Epub 2008 Jul 10.
J Pharm Biomed Anal. 2008.
PMID: 18692338
Conformers of dehydrogenated glycine isomers.
Orján EM, Nacsa AB, Czakó G.
Orján EM, et al. Among authors: nacsa ab.
J Comput Chem. 2020 Aug 15;41(22):2001-2014. doi: 10.1002/jcc.26375. Epub 2020 Jun 24.
J Comput Chem. 2020.
PMID: 32579272
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Benchmark ab initio proton affinity of glycine.
Nacsa AB , Czakó G .
Nacsa AB , et al.
Phys Chem Chem Phys. 2021 Apr 28;23(16):9663-9671. doi: 10.1039/d1cp00376c.
Phys Chem Chem Phys. 2021.
PMID: 33908507
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Dynamics of the Cl- + CH3I reaction on a high-level ab initio analytical potential energy surface.
Nacsa AB, Tajti V, Czakó G.
Nacsa AB, et al.
J Chem Phys. 2023 May 21;158(19):194306. doi: 10.1063/5.0151259.
J Chem Phys. 2023.
PMID: 37194716
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Benchmark Ab Initio Determination of the Conformers, Proton Affinities, and Gas-Phase Basicities of Cysteine.
Nacsa AB, Czakó G.
Nacsa AB, et al.
J Phys Chem A. 2022 Dec 29;126(51):9667-9679. doi: 10.1021/acs.jpca.2c07035. Epub 2022 Dec 16.
J Phys Chem A. 2022.
PMID: 36524999
Free PMC article.
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Protonation of serine: conformers, proton affinities and gas-phase basicities at the "gold standard" and beyond.
Nacsa AB, Kígyósi M, Czakó G.
Nacsa AB, et al.
Phys Chem Chem Phys. 2023 Mar 22;25(12):8891-8902. doi: 10.1039/d3cp00612c.
Phys Chem Chem Phys. 2023.
PMID: 36916632
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The influence of fluorination on the dynamics of the F- + CH3CH2I reaction.
Gstir T, Michaelsen T, Long BA, Nacsa AB, Ayasli A, Swaraj D, Zappa F, Trummer F, Ard SG, Shuman NS, Czakó G, Viggiano AA, Wester R.
Gstir T, et al. Among authors: nacsa ab.
Phys Chem Chem Phys. 2023 Jul 19;25(28):18711-18719. doi: 10.1039/d3cp02110f.
Phys Chem Chem Phys. 2023.
PMID: 37409391
Free PMC article.
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High-level analytical potential-energy-surface-based dynamics of the OH- + CH3CH2Cl SN2 and E2 reactions in full (24) dimensions.
Nacsa AB, Tokaji C, Czakó G.
Nacsa AB, et al.
Faraday Discuss. 2024 May 28. doi: 10.1039/d3fd00161j. Online ahead of print.
Faraday Discuss. 2024.
PMID: 38804112
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