Predictive machine learning models for rational permeability design in de novo macrocycle engineering: a review.

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Title: Predictive machine learning models for rational permeability design in de novo macrocycle engineering: a review.
Authors: Albrijawi MT; Department of Biomedical Engineering and Bioinformatics, Istanbul Medipol University, Istanbul, Turkey., Alhajj R; Department of Computer Science, University of Calgary, Calgary, Alberta, Canada. alhajj@ucalgary.ca.; Department of Health Informatics, University of Southern Denmark, Odense, Denmark. alhajj@ucalgary.ca.; Department of Computer Engineering, Istanbul Medipol University, Istanbul, Turkey. alhajj@ucalgary.ca.
Source: Journal of cheminformatics [J Cheminform] 2026 Apr 21; Vol. 18 (1). Date of Electronic Publication: 2026 Apr 21.
Publication Type: Journal Article; Review
Journal Info: Publisher: BioMed Central Country of Publication: England NLM ID: 101516718 Publication Model: Electronic Cited Medium: Print ISSN: 1758-2946 (Print) Linking ISSN: 17582946 NLM ISO Abbreviation: J Cheminform Subsets: PubMed not MEDLINE
Database: MEDLINE Ultimate
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PubType: Academic Journal
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  Data: Predictive machine learning models for rational permeability design in de novo macrocycle engineering: a review.
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  Data: <searchLink fieldCode="AU" term="%22Albrijawi+MT%22">Albrijawi MT</searchLink>; Department of Biomedical Engineering and Bioinformatics, Istanbul Medipol University, Istanbul, Turkey.<br /><searchLink fieldCode="AU" term="%22Alhajj+R%22">Alhajj R</searchLink>; Department of Computer Science, University of Calgary, Calgary, Alberta, Canada. alhajj@ucalgary.ca.; Department of Health Informatics, University of Southern Denmark, Odense, Denmark. alhajj@ucalgary.ca.; Department of Computer Engineering, Istanbul Medipol University, Istanbul, Turkey. alhajj@ucalgary.ca.
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  Data: <searchLink fieldCode="JN" term="%22101516718%22">Journal of cheminformatics</searchLink> [J Cheminform] 2026 Apr 21; Vol. 18 (1). <i>Date of Electronic Publication: </i>2026 Apr 21.
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  Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22BioMed+Central%22">BioMed Central </searchLink><i>Country of Publication: </i>England <i>NLM ID: </i>101516718 <i>Publication Model: </i>Electronic <i>Cited Medium: </i>Print <i>ISSN: </i>1758-2946 (Print) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2217582946%22">17582946 </searchLink><i>NLM ISO Abbreviation: </i>J Cheminform <i>Subsets: </i>PubMed not MEDLINE
PLink https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=mdl&AN=42015308
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        Value: 10.1186/s13321-026-01189-3
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        Text: English
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      – TitleFull: Predictive machine learning models for rational permeability design in de novo macrocycle engineering: a review.
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            NameFull: Albrijawi MT
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              Text: 2026 Apr 21
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