Torx® Design
Sketch and share new molecule ideas in your custom information-rich design environment
Torx Design provides an environment to lay out key data to make informed decisions around molecule design.
Sketch designs using input from critical physico-chemical and 3D pose information
Connect medicinal and computational chemists through a single platform, to enhance cross-team cooperation and accelerate the design of new small molecules.
Review and feedback on designs in real-time
Torx offers an out-of-the-box integration allowing Flare users to fetch compounds, proteins and reference ligands to perform experiments such as docking and Free Energy Perturbation (FEP). Generated molecules and related data can then be sent instantly back to Torx, enabling the project team to make more informed decisions.
Seamless sharing of molecule data between Torx and Flare
The LeadFinder algorithm in Torx has been expanded to include covalent docking as a standard feature, to support the increasing need to assess candidate covalent binders in silico.
Label on molecule cards indicates when a molecule has a 3D pose
Covalent docking in Torx Design