Weak Noncovalent Interactions in Three Closely Related Adamantane-Linked 1,2,4-Triazole N -Mannich Bases: Insights from Energy Frameworks, Hirshfeld Surface Analysis, In Silico 11β-HSD1 Molecular Docking and ADMET Prediction.
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| Title: | Weak Noncovalent Interactions in Three Closely Related Adamantane-Linked 1,2,4-Triazole N -Mannich Bases: Insights from Energy Frameworks, Hirshfeld Surface Analysis, In Silico 11β-HSD1 Molecular Docking and ADMET Prediction. |
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| Authors: | Al-Wahaibi, Lamya H.1 (AUTHOR) lhalwahaibi@pnu.edu.sa, Macías, Mario A.2 (AUTHOR), Blacque, Olivier3 (AUTHOR), Zondagh, Luke S.4 (AUTHOR), Joubert, Jacques4 (AUTHOR), Thamotharan, Subbiah5 (AUTHOR), Percino, María Judith6 (AUTHOR), Mohamed, Ahmed A. B.7 (AUTHOR), El-Emam, Ali A.7 (AUTHOR) lhalwahaibi@pnu.edu.sa |
| Source: | Molecules. Nov2022, Vol. 27 Issue 21, p7403. 27p. |
| Database: | Academic Search Ultimate |
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| Header | DbId: asn DbLabel: Academic Search Ultimate An: 160217842 AccessLevel: 2 PubType: Academic Journal PubTypeId: academicJournal PreciseRelevancyScore: 0 |
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| Items | – Name: Title Label: Title Group: Ti Data: Weak Noncovalent Interactions in Three Closely Related Adamantane-Linked 1,2,4-Triazole N -Mannich Bases: Insights from Energy Frameworks, Hirshfeld Surface Analysis, In Silico 11β-HSD1 Molecular Docking and ADMET Prediction. – Name: Author Label: Authors Group: Au Data: <searchLink fieldCode="AR" term="%22Al-Wahaibi%2C+Lamya+H%2E%22">Al-Wahaibi, Lamya H.</searchLink><relatesTo>1</relatesTo> (AUTHOR)<i> lhalwahaibi@pnu.edu.sa</i><br /><searchLink fieldCode="AR" term="%22Macías%2C+Mario+A%2E%22">Macías, Mario A.</searchLink><relatesTo>2</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Blacque%2C+Olivier%22">Blacque, Olivier</searchLink><relatesTo>3</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Zondagh%2C+Luke+S%2E%22">Zondagh, Luke S.</searchLink><relatesTo>4</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Joubert%2C+Jacques%22">Joubert, Jacques</searchLink><relatesTo>4</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Thamotharan%2C+Subbiah%22">Thamotharan, Subbiah</searchLink><relatesTo>5</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Percino%2C+María+Judith%22">Percino, María Judith</searchLink><relatesTo>6</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Mohamed%2C+Ahmed+A%2E+B%2E%22">Mohamed, Ahmed A. B.</searchLink><relatesTo>7</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22El-Emam%2C+Ali+A%2E%22">El-Emam, Ali A.</searchLink><relatesTo>7</relatesTo> (AUTHOR)<i> lhalwahaibi@pnu.edu.sa</i> – Name: TitleSource Label: Source Group: Src Data: <searchLink fieldCode="JN" term="%22Molecules%22">Molecules</searchLink>. Nov2022, Vol. 27 Issue 21, p7403. 27p. |
| PLink | https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=asn&AN=160217842 |
| RecordInfo | BibRecord: BibEntity: Identifiers: – Type: doi Value: 10.3390/molecules27217403 Languages: – Code: eng Text: English PhysicalDescription: Pagination: PageCount: 27 StartPage: 7403 Titles: – TitleFull: Weak Noncovalent Interactions in Three Closely Related Adamantane-Linked 1,2,4-Triazole N -Mannich Bases: Insights from Energy Frameworks, Hirshfeld Surface Analysis, In Silico 11β-HSD1 Molecular Docking and ADMET Prediction. Type: main BibRelationships: HasContributorRelationships: – PersonEntity: Name: NameFull: Al-Wahaibi, Lamya H. – PersonEntity: Name: NameFull: Macías, Mario A. – PersonEntity: Name: NameFull: Blacque, Olivier – PersonEntity: Name: NameFull: Zondagh, Luke S. – PersonEntity: Name: NameFull: Joubert, Jacques – PersonEntity: Name: NameFull: Thamotharan, Subbiah – PersonEntity: Name: NameFull: Percino, María Judith – PersonEntity: Name: NameFull: Mohamed, Ahmed A. B. – PersonEntity: Name: NameFull: El-Emam, Ali A. IsPartOfRelationships: – BibEntity: Dates: – D: 01 M: 11 Text: Nov2022 Type: published Y: 2022 Identifiers: – Type: issn-print Value: 14203049 Numbering: – Type: volume Value: 27 – Type: issue Value: 21 Titles: – TitleFull: Molecules Type: main |
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