Results 271 to 280 of about 769,952 (357)

Smart Integration of Structural Biology and Medicinal Chemistry to Unlock Target‐Driven Drug Discovery

open access: yesMedicinal Research Reviews, EarlyView.
ABSTRACT To enhance drug discovery efforts, medicinal chemists should evaluate, filter, and utilize relevant structural information about target proteins. Acquiring and interpreting protein structures is crucial for elucidating ligand‐receptor interactions and addressing ADME‐related considerations, making it an essential aspect of medicinal chemistry.
Matteo Rossi Sebastiano   +4 more
wiley   +1 more source

Machine Learning Design of Tungsten Alloys With Strength–Ductility Synergy

open access: yesMaterials Genome Engineering Advances, EarlyView.
This study integrates machine learning with solid solution softening knowledge to design multielement tungsten alloys with strength‐ductility synergy. ML models identify promising compositions within W‐ Ta ‐ Re system that exhibit pronounced chemical short‐range order, resulting in exceptional mechanical performance. Experimental validation through the
Juan Ding   +7 more
wiley   +1 more source

Taxonomic reappraisal of the mangrove genus Avicennia (Acanthaceae) in India

open access: yesNordic Journal of Botany, EarlyView.
A taxonomic reappraisal of the mangrove genus Avicennia in India was undertaken through extensive field surveys and critical examination of herbarium specimens. Three taxa, Avicennia alba, Avicennia marina subsp. marina, and Avicennia officinalis, are described in detail. A synonymic list was compiled using the World Checklist of Vascular Plants (WCVP)
Subrata Mondal, Saikat Naskar
wiley   +1 more source

Discovery of Covalent Ligands with AlphaFold3. [PDF]

open access: yesJ Am Chem Soc
Shamir Y   +5 more
europepmc   +1 more source

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