Ligand-Based Approach for Multi-Target Drug Discovery: PTML Modeling of Triple-Target Inhibitors.
Valeria V KleandrovaMaria Natália Dias Soeiro CordeiroAlejandro Speck-PlanchePublished in: Current topics in medicinal chemistry (2024)
Our study envisages the capabilities of combining PTML modeling with FBTD for the generation of new chemical diversity for multi-target drug discovery in oncology research and beyond.
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