A5095950965- Innovative Microfluidic and Catalytic Techniques Innovation
- Chemical Synthesis and Analysis
- Computational Drug Discovery Methods
Centre National de la Recherche Scientifique
2024
Inserm
2024
Institut Paoli-Calmettes
2024
Abstract In drug discovery, the successful optimization of an initial hit compound into a lead molecule requires multiple cycles chemical modification. Consequently, there is need to efficiently generate synthesizable libraries navigate space surrounding primary hit. To address this need, we introduce ChemoDOTS, easy-to-use web server for hit-to-lead freely available at https://chemodots.marseille.inserm.fr/. With tool, users enter activated form then choose from automatically detected...