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                                            youngh

KeyError: 'minimizedAffinity' in tests

Hi, thanks for sharing. However, when I use ptest tests: 4 failed with flowing message: FAILED tests/test_data.py::TestMolDataset::test_benchmark[False] - ValueError: Could not read data/crossdock2020/1A02_HUMAN_25_199_pep_0/1t1z_A_rec.pdb FAILED tests/test_data.py::TestMolDataset::test_benchmark[True] - AssertionError: file does not...