This repository is a personal usage of UniMol
mamba create -n unimol python==3.10
mamba activate unimol
mamba install pytorch==2.3.1 pytorch-cuda=12.1 -c pytorch -c nvidia
pip install rdkit==2022.9.5
pip install unimol_tools
pip install huggingface_hub
# Download the pretrained model
export HF_ENDPOINT=https://hf-mirror.com
huggingface-cli download --resume-download dptech/Uni-Mol-Models --local-dir path/to/your/conda/envs/unimol/lib/python3.10/site-packages/unimol_tools/weights --local-dir-use-symlinks False