diff --git a/README.md b/README.md index 6f48d22..c9242ce 100644 --- a/README.md +++ b/README.md @@ -81,6 +81,7 @@ To install the required dependencies run the following commands. Replace `cu121` Unless you intend to define your own custom scoring functions, install MolScore by running + pip3 install rdkit==2023.3.3, joblib pip3 install MolScore To use the scaffold decoration and fragment linking, install promptsmiles by running