diff --git a/README.md b/README.md index ce2ab7c..2c370d9 100644 --- a/README.md +++ b/README.md @@ -77,7 +77,6 @@ We recommend to install it locally since Binder needs to be refreshed every time ```bash conda create -n DeepPurpose python=3.6 conda activate DeepPurpose -conda install -c conda-forge rdkit conda install -c conda-forge notebook pip install git+https://github.com/bp-kelley/descriptastorus pip install DeepPurpose diff --git a/requirements.txt b/requirements.txt index 33fcdc4..48afd2e 100644 --- a/requirements.txt +++ b/requirements.txt @@ -1,3 +1,4 @@ +rdkit-pypi numpy pandas tqdm