Med-Tech Innovation July 25, 2024
Cresset, a provider of integrated in silicosolutions for drug discovery has announced the release of V9 – the latest version of its Flare platform for ligand-based and structure-based design, which includes a full integration of Spark, the company’s bioisostere replacement solution.
Flare users will be able to use the range of capabilities brought by this integration to generate ideas for their design projects, while enabling improved efficiencies with custom workflows and task automation via the Flare Python API.
Key Spark features including scaffold hopping and R-group replacement, ligand macrocyclisation, growing and docking, joining two ligands, water replacement and access to the new ‘Linkers’ databases, for linker degrader design, allow even more creativity and streamlining of the small molecule discovery process.
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