Application Software
- AFITT - Crystallographic refinement and analysis.
- BROOD - Bioisostere identification using shape, chemistry and electrostatic similarity.
- EON - Chemical similarity analysis via comparison of electrostatics overlay.
- FILTER - Molecular screening and selection based on physical property or functional group.
- FRED - Extremely fast, systematic docking search for ligand binding within a protein active site.
- OMEGA - Systematic high-throughput conformer generation, including 1D or 2D to 3D structure generation.
- QUACPAC - Quality charge states and charges for small molecules and proteins.
- ROCS - Chemical similarity analysis via rapid 3D molecular shape searches.
- SZYBKI - Fast structure optimization of ligands in gas-phase, solution, or within a protein active site.
- VIDA - Graphical user interface that visualizes, analyzes and manages corporate collections of molecular structures and information.
- VIVANT - Live molecular visualization inside of PowerPoint and web browsers.
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