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ImportError: cannot import name 'cpdGeneration_algorithm_optimized' from 'mmpdblib' (/home/xyd/anaconda3/envs/mcts/lib/python3.7/site-packages/mmpdblib/init.py)
I came across the same problem. And I actually finished the steps below, but still encountered such problem. The conda environment is aligned with requirements in README.md.
git clone https://github.com/mahendra-awale/medchem_moves cd medchem_moves python setup.py install