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gang liu
2024-01-29 19:49:14 -05:00
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README.md
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@@ -14,7 +14,7 @@ This is the code for MCD: a Multi-Conditional Diffusion Model for inverse small
## Requirements
All dependencies are specified in the `requirements.txt` file.
This code was developed and tested with Python 3.9.16, PyTorch 2.0.0, and PyG 2.3.0, pytorch-lightning 2.0.1.
This code was developed and tested with Python 3.9.16, PyTorch 2.0.0, and PyG 2.3.0, Pytorch-lightning 2.0.1.
For molecular generation evaluation, we should first install rdkit: