Flare™ V8 is available now! Join us in this webinar for an overview of the exciting new science and features in this release.
New and enhanced structure-based methods include MM/GBSA single-point calculations to rapidly prioritize the best molecules; significantly expanded applicability of Flare FEP, now supporting projects including ligands with different net charge; new and enhanced visual analysis tools for troubleshooting and understanding the results of FEP and Molecular Dynamics experiments; new and enhanced features for protein and homology modeling.
Enhanced ligand-based functionality includes the calculation and display of HOMO/LUMO orbitals for QM calculations, a significant expansion of the collection of ready-to-use reactions available for library enumeration, and more comprehensive ligand preparation.




