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💫 About me:

💻 I am currently studying at Imperial College London (MSc Advanced Computing)

🎓 Before ICL, I’ve been studying at CentraleSupélec, where I specialized in Applied Mathematics and Computer Science (2nd best French engineering school). It is part of the Paris-Saclay University (1st in Mathematics, Shanghai Ranking 2023).

🏫 My research interests are mainly Geometric Deep Learning and diffusion models.

🔥 And I like dancing :)

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running pytest error

Hi,
Thanks for your contribution, I tried to run the code but when running the pytests I got the following errors:

====================================================================== short test summary info =======================================================================
FAILED tests/utils/test_cc_utils.py::test_cc_incidence_advanced_test - assert False
FAILED tests/utils/test_cc_utils.py::test_mols_to_cc - AssertionError: assert {0: {frozense...'weight': 1}}} == {0: {frozense...'weight': 1}}}
FAILED tests/utils/test_cc_utils.py::test_CC_to_incidence_matrices - assert False
FAILED tests/utils/test_cc_utils.py::test_ccs_to_mol - KeyError: 'symbol'
FAILED tests/utils/test_cc_utils.py::test_convert_CC_to_graphs - AssertionError: assert {0: {'weight'...ght': 1}, ...} == {0: {'symbol'...ght': 1}, ...}
FAILED tests/utils/test_cc_utils.py::test_convert_graphs_to_CCs - AssertionError: assert {'weight': 1} == {'label': 'C', 'weight': 1}
FAILED tests/utils/test_cc_utils.py::test_rank0_distrib_worker - KeyError: 'label_0'
FAILED tests/utils/test_cc_utils.py::test_rank0_distrib_stats - KeyError: 'label_0'
FAILED tests/utils/test_cc_utils.py::test_eval_CC_list - KeyError: 'label_0'
=================================================================== 9 failed, 131 passed in 4.74s ====================================================================

Any hints for how to solve this?

Best,
Yamei

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