RGroupDecompositionAction
Back to index pageDescription: R-group decomposition is a special kind of substructure search that aims at finding a central structure (scaffold) and identify its ligands at certain attachment positions. The query molecule consists of the scaffold and ligand attachment points represented by R-groups. These R-groups are simple R-group atoms without R-group definitions in most cases.
Details: R-group Decomposition
Back to index page
Do you have a question? Would you like to learn more? Please browse among the related topics on our support forum or search the website. If you want to suggest modifications or improvements to our documentation email our support directly!