chemparse==0.3.1
CIRpy==1.0.2
fuzzywuzzy==0.18.0
matplotlib==3.9.2
molmass==2021.6.18
ms_entropy==1.3.3
numexpr==2.10.1
numpy==2.1.1
pandas==2.2.3
plotly==5.24.1
PubChemPy==1.0.4
rdkit==2024.3.5
Requests==2.32.3
scikit_learn==1.5.2
scipy==1.14.1
seaborn==0.13.2
tqdm==4.66.5
