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.
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.
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  Data: Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations.
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  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>
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  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:
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      – Type: doi
        Value: 10.1038/s42004-026-02022-6
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      – Code: eng
        Text: English
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        PageCount: 11
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      – TitleFull: Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations.
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            NameFull: Ansari, Narjes
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            NameFull: Aviat, Félix
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            NameFull: Hénin, Jérôme
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            NameFull: Piquemal, Jean-Philip
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            – D: 08
              M: 05
              Text: 5/8/2026
              Type: published
              Y: 2026
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              Value: 9
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            – TitleFull: Communications Chemistry
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