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Quantitative structure-property relationship modeling of polar analytes lacking UV chromophores to charged aerosol detector response.
Anal Bioanal Chem. 2019 May;411(13):2945-2959. doi: 10.1007/s00216-019-01744-y. Epub 2019 Mar 26.
Anal Bioanal Chem. 2019.
PMID: 30911799
Charged aerosol detector response modeling for fatty acids based on experimental settings and molecular features: a machine learning approach.
Pawellek R, Krmar J, Leistner A, Djajić N, Otašević B, Protić A, Holzgrabe U.
Pawellek R, et al.
J Cheminform. 2021 Jul 15;13(1):53. doi: 10.1186/s13321-021-00532-0.
J Cheminform. 2021.
PMID: 34266497
Free PMC article.
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Influence of charged aerosol detector instrument settings on the ultra-high-performance liquid chromatography analysis of fatty acids in polysorbate 80.
Schilling K, Pawellek R, Lovejoy K, Muellner T, Holzgrabe U.
Schilling K, et al. Among authors: pawellek r.
J Chromatogr A. 2018 Nov 16;1576:58-66. doi: 10.1016/j.chroma.2018.09.031. Epub 2018 Sep 18.
J Chromatogr A. 2018.
PMID: 30245073
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Impurity profiling of l-aspartic acid and glycine using high-performance liquid chromatography coupled with charged aerosol and ultraviolet detection.
Pawellek R, Schilling K, Holzgrabe U.
Pawellek R, et al.
J Pharm Biomed Anal. 2020 May 10;183:113149. doi: 10.1016/j.jpba.2020.113149. Epub 2020 Feb 5.
J Pharm Biomed Anal. 2020.
PMID: 32058290
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Power function setting in charged aerosol detection for the linearization of detector response - optimization strategies and their application.
Pawellek R, Muellner T, Gamache P, Holzgrabe U.
Pawellek R, et al.
J Chromatogr A. 2021 Jan 25;1637:461844. doi: 10.1016/j.chroma.2020.461844. Epub 2020 Dec 25.
J Chromatogr A. 2021.
PMID: 33445033
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Influence of the mobile phase composition on hyphenated ultraviolet and charged aerosol detection for the impurity profiling of vigabatrin.
Pawellek R, Holzgrabe U.
Pawellek R, et al.
J Pharm Biomed Anal. 2021 Jul 15;201:114110. doi: 10.1016/j.jpba.2021.114110. Epub 2021 May 3.
J Pharm Biomed Anal. 2021.
PMID: 33971590
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Performance of ion pairing chromatography and hydrophilic interaction liquid chromatography coupled to charged aerosol detection for the analysis of underivatized amino acids.
Pawellek R, Holzgrabe U.
Pawellek R, et al.
J Chromatogr A. 2021 Dec 6;1659:462613. doi: 10.1016/j.chroma.2021.462613. Epub 2021 Oct 13.
J Chromatogr A. 2021.
PMID: 34731754
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