MedChemesis creates a series of 3D analogs of the ligand in the binding site, applying up to 290 medicinal chemistry-inspired transformations triggered by one click on all molecules added to the Inspirator. The Inspirator mode gets another feather to its hat with the introduction of MedChemesis! MedChemesis: Addition to the Inspirator Mode.If a project created with a previous SeeSAR version is opened in SeeSAR 13, a subsequent rescoring of poses will be required. Therefore, affinity calculations may vary between version 13 and older version of SeeSAR. Important note: SeeSAR 13 comes with an updated HYDE chemistry model. SeeSAR 13 was created to provide users with all tools required to transform their compound into valuable ideas with a single click.
0 Comments
Leave a Reply. |
AuthorWrite something about yourself. No need to be fancy, just an overview. ArchivesCategories |