| name: virtual-human-chc-hyformer |
| channels: |
| - conda-forge |
| dependencies: |
| - python=3.9 |
| - pip |
| - numpy>=1.26,<2.0 |
| - pandas=1.5.3 |
| - rdkit=2023.9.2 |
| - scipy=1.10.1 |
| - tqdm=4.67.1 |
| - transformers=4.55.2 |
| - wandb=0.21.1 |
|
|
| - pip: |
| - --extra-index-url https://download.pytorch.org/whl/cu118 |
| - torch==2.2.2+cu118 |
| - torchvision==0.17.2+cu118 |
| - torchaudio==2.2.2+cu118 |
| - deepchem==2.8.0 |
| - guacamol |
| - fcd==1.2 |
| - pillow<10 |
| - git+https://github.com/HelmholtzAI-Consultants-Munich/virtual_human_Hyformer.git@main#subdirectory=hyformer |
