diff --git a/README.md b/README.md index 5a06f39..2345216 100644 --- a/README.md +++ b/README.md @@ -5,7 +5,7 @@ git clone https://github.com/swansonk14/admet_ai cd admet_ai micromamba create -n admet_ai python=3.10 micromamba activate admet_ai -pip install -r requirements.txt +# pip install -r requirements.txt pip install -e . admet_predict --data_path ./data/molecules.csv --save_path ./data/preds.csv --smiles_column smiles $env:OMP_NUM_THREADS="12"