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Unveiling KRAS G12D inhibition: from molecular dynamics to therapeutic strategies.

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Title: Unveiling KRAS G12D inhibition: from molecular dynamics to therapeutic strategies.
Authors: Omotara BS; Department of Chemistry, University of New Haven, West Haven, CT, USA., Solanki PR; Department of Chemistry, University of New Haven, West Haven, CT, USA., Manica AK; Department of Chemistry, University of New Haven, West Haven, CT, USA., Ajala CF; Department of Public Health, University of New Haven, West Haven, CT, USA., Junaid IO; Department of Chemistry and Chemical Biology, Stevens Institute of Technology, Hoboken, NJ, USA., Anifowose LO; Graduate Program in Translational Biology, Medicine and Health, Virginia Tech, Blacksburg, VA, USA., Adeniran TR; Department of Chemistry and Biochemistry, Baylor University, Waco, TX, USA., Nwachukwu F; Department of Chemistry, University of Kansas, Lawrence, KS, USA., Farayola RO; Department of Biology, Georgia State University, Atlanta, GA, USA., Abdulrazaq IT; Department of Biomedical Engineering, University of Lagos, Yaba, Lagos State, Nigeria., Ashiru MA; Department of Chemistry & Biochemistry, Texas Tech University, Lubbock, TX, USA., Oyedele AK; Department of Chemistry, University of New Haven, West Haven, CT, USA.; Department of Biochemistry, University of Utah, Salt Lake City, UT, USA.
Source: Journal of biomolecular structure & dynamics [J Biomol Struct Dyn] 2026 Jul; Vol. 44 (11), pp. 5129-5152. Date of Electronic Publication: 2025 Sep 23.
Publication Type: Journal Article
Journal Info: Publisher: Taylor & Francis Country of Publication: England NLM ID: 8404176 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1538-0254 (Electronic) Linking ISSN: 07391102 NLM ISO Abbreviation: J Biomol Struct Dyn Subsets: MEDLINE
Database: MEDLINE Ultimate
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  Data: Unveiling KRAS G12D inhibition: from molecular dynamics to therapeutic strategies.
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  Data: <searchLink fieldCode="AU" term="%22Omotara+BS%22">Omotara BS</searchLink>; Department of Chemistry, University of New Haven, West Haven, CT, USA.<br /><searchLink fieldCode="AU" term="%22Solanki+PR%22">Solanki PR</searchLink>; Department of Chemistry, University of New Haven, West Haven, CT, USA.<br /><searchLink fieldCode="AU" term="%22Manica+AK%22">Manica AK</searchLink>; Department of Chemistry, University of New Haven, West Haven, CT, USA.<br /><searchLink fieldCode="AU" term="%22Ajala+CF%22">Ajala CF</searchLink>; Department of Public Health, University of New Haven, West Haven, CT, USA.<br /><searchLink fieldCode="AU" term="%22Junaid+IO%22">Junaid IO</searchLink>; Department of Chemistry and Chemical Biology, Stevens Institute of Technology, Hoboken, NJ, USA.<br /><searchLink fieldCode="AU" term="%22Anifowose+LO%22">Anifowose LO</searchLink>; Graduate Program in Translational Biology, Medicine and Health, Virginia Tech, Blacksburg, VA, USA.<br /><searchLink fieldCode="AU" term="%22Adeniran+TR%22">Adeniran TR</searchLink>; Department of Chemistry and Biochemistry, Baylor University, Waco, TX, USA.<br /><searchLink fieldCode="AU" term="%22Nwachukwu+F%22">Nwachukwu F</searchLink>; Department of Chemistry, University of Kansas, Lawrence, KS, USA.<br /><searchLink fieldCode="AU" term="%22Farayola+RO%22">Farayola RO</searchLink>; Department of Biology, Georgia State University, Atlanta, GA, USA.<br /><searchLink fieldCode="AU" term="%22Abdulrazaq+IT%22">Abdulrazaq IT</searchLink>; Department of Biomedical Engineering, University of Lagos, Yaba, Lagos State, Nigeria.<br /><searchLink fieldCode="AU" term="%22Ashiru+MA%22">Ashiru MA</searchLink>; Department of Chemistry & Biochemistry, Texas Tech University, Lubbock, TX, USA.<br /><searchLink fieldCode="AU" term="%22Oyedele+AK%22">Oyedele AK</searchLink>; Department of Chemistry, University of New Haven, West Haven, CT, USA.; Department of Biochemistry, University of Utah, Salt Lake City, UT, USA.
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  Data: <searchLink fieldCode="JN" term="%228404176%22">Journal of biomolecular structure & dynamics</searchLink> [J Biomol Struct Dyn] 2026 Jul; Vol. 44 (11), pp. 5129-5152. <i>Date of Electronic Publication: </i>2025 Sep 23.
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  Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22Taylor+%26+Francis%22">Taylor & Francis </searchLink><i>Country of Publication: </i>England <i>NLM ID: </i>8404176 <i>Publication Model: </i>Print-Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>1538-0254 (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2207391102%22">07391102 </searchLink><i>NLM ISO Abbreviation: </i>J Biomol Struct Dyn <i>Subsets: </i>MEDLINE
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        Value: 10.1080/07391102.2025.2563084
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              Text: 2026 Jul
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