numpy<1.25,>=1.21
editdistance>=0.6.0
Biopython==1.79
click>=8.1.3
biopandas>=0.4.1
boto3
p_tqdm>=1.4.0
networkx==2.8.8
einops>=0.6.0
pandas>=1.5.2
torch>=1.10.0
biotite==0.35.0
aiobotocore
awscli
bs4>=0.0.1
pyyaml>=6
rcsbsearch
pre-commit
rdkit
pypdb
joblib

[processing]
py3Dmol
methodtools
tmtools
fair-esm
MDAnalysis
ablang
igfold
immunebuilder
blosum>=2.0
