Dr. Pradyumna Kumar Pradhan

Plasma Protein Binding Prediction under Scaffold Split: Tree Models, ChemBERTa, Graph Networks, and Late Fusion

From idea generation to testing, drug discovery is a lengthy and expensive process. Rather than chasing all of their molecule ideas, scientists prioritize certain molecules that are more likely to be successful, from synthesis to safety to therapeutic use. Machine learning and AI enable researchers to narrow their cand...