We will give an overview of the new and enhanced features in Flare V6. You will learn how Flare can:
- Refine your docking results, make the right structure-based design choices and enable lead optimization with confidence, using Flare FEP
- Provide an accurate description of a ligand’s electronic structure, enabling molecular electrostatic potentials to be calculated at a high level of theory, using state-of-the-art Quantum Mechanics
- Quickly generate in silico chemical libraries and arrays, using library enumeration
- Get visual identification of problematic torsions on the fly, using Torsion Analysis
- Accelerate the pace of innovation and achieve project milestones more quickly and with better outcomes
- Better utilize human and computer resources, leading to fewer failed ‘wet’ experiments, lower cost and reduced cycle times
- Give additional insights into your projects and molecules by using novel cutting-edge methods to study your molecular systems, and generating detailed and information-rich high-resolution images
