requirements.txt

ase==3.22.1
PyCifRW==4.4.6
gradio==4.26.0
memory_profiler==0.61.0
mendeleev==0.15.0
numpy==1.26.4
pandas==2.2.2
periodictable==1.6.1
pymatgen==2023.11.12
Requests==2.31.0
scipy==1.13.0
torch==2.1.1
torch-geometric==2.4.0
pytorch-lightning~=2.3.0
numpy~=1.26.4
chardet~=5.2.0
networkx~=3.2.1
matplotlib~=3.8.2
gopy~=0.7.3
tqdm~=4.66.4