Official implementation of MADGEN: Mass-Spec attends to De Novo Molecular generation by Yinkai Wang, Xiaohui Chen, Liping Liu, and Soha Hassoun. MADGEN is a novel approach for de novo molecular ...
Run the following commands in your terminal to set up propmolflow (We have tested the installation on Nvidia L4 and Blackwell B200 GPUs): conda install mamba # if you ...
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