Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations.
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| Title: | Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations. |
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| Authors: | Ansari, Narjes1 (AUTHOR) narjesa@qubit-pharmaceuticals.com, Aviat, Félix1 (AUTHOR) felix.aviat@qubit-pharmaceuticals.com, Hénin, Jérôme2 (AUTHOR), Piquemal, Jean-Philip1,3 (AUTHOR), Lagardère, Louis1,3 (AUTHOR) louis.lagardere@sorbonne-universite.fr |
| Source: | Communications Chemistry. 5/8/2026, Vol. 9 Issue 1, p1-11. 11p. |
| Database: | Academic Search Ultimate |
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| FullText | Links: – Type: pdflink Text: Availability: 1 |
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| Header | DbId: asn DbLabel: Academic Search Ultimate An: 195342800 AccessLevel: 2 PubType: Academic Journal PubTypeId: academicJournal PreciseRelevancyScore: 0 |
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| Items | – Name: Title Label: Title Group: Ti Data: Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations. – Name: Author Label: Authors Group: Au Data: <searchLink fieldCode="AR" term="%22Ansari%2C+Narjes%22">Ansari, Narjes</searchLink><relatesTo>1</relatesTo> (AUTHOR)<i> narjesa@qubit-pharmaceuticals.com</i><br /><searchLink fieldCode="AR" term="%22Aviat%2C+Félix%22">Aviat, Félix</searchLink><relatesTo>1</relatesTo> (AUTHOR)<i> felix.aviat@qubit-pharmaceuticals.com</i><br /><searchLink fieldCode="AR" term="%22Hénin%2C+Jérôme%22">Hénin, Jérôme</searchLink><relatesTo>2</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Piquemal%2C+Jean-Philip%22">Piquemal, Jean-Philip</searchLink><relatesTo>1,3</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Lagardère%2C+Louis%22">Lagardère, Louis</searchLink><relatesTo>1,3</relatesTo> (AUTHOR)<i> louis.lagardere@sorbonne-universite.fr</i> – Name: TitleSource Label: Source Group: Src Data: <searchLink fieldCode="JN" term="%22Communications+Chemistry%22">Communications Chemistry</searchLink>. 5/8/2026, Vol. 9 Issue 1, p1-11. 11p. |
| PLink | https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=asn&AN=195342800 |
| RecordInfo | BibRecord: BibEntity: Identifiers: – Type: doi Value: 10.1038/s42004-026-02022-6 Languages: – Code: eng Text: English PhysicalDescription: Pagination: PageCount: 11 StartPage: 1 Titles: – TitleFull: Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations. Type: main BibRelationships: HasContributorRelationships: – PersonEntity: Name: NameFull: Ansari, Narjes – PersonEntity: Name: NameFull: Aviat, Félix – PersonEntity: Name: NameFull: Hénin, Jérôme – PersonEntity: Name: NameFull: Piquemal, Jean-Philip – PersonEntity: Name: NameFull: Lagardère, Louis IsPartOfRelationships: – BibEntity: Dates: – D: 08 M: 05 Text: 5/8/2026 Type: published Y: 2026 Identifiers: – Type: issn-print Value: 23993669 Numbering: – Type: volume Value: 9 – Type: issue Value: 1 Titles: – TitleFull: Communications Chemistry Type: main |
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