In this webinar, Daniel Cheney, former Scientific Director at Bristol Myers Squibb, will share insights from his career as a computational chemist. He will highlight the importance of developing a deep understanding of molecular structure and interactions in molecular design, illustrating key concepts through examples that integrate quantum chemistry with experimental structural data.
Topics will include:
The webinar will showcase the application of CCDC drug discovery tools, including ConQuest and CrossMiner, in combination with quantum chemical methods.
Topics will include:
- Fundamentals of molecular interactions.
- Halogen bonding and the significance of contextual factors
- Aromatic interactions: myths, underlying determinants, and case studies
- Conformational biasing in molecular design
The webinar will showcase the application of CCDC drug discovery tools, including ConQuest and CrossMiner, in combination with quantum chemical methods.
