numpy>=1.22
pandas>=1.3
pyyaml>=6.0
scipy>=1.7
fabric>=2.6
paramiko>=3.1
pymongo>=3.10
appdirs>=1.4
ipywidgets>=8.0
py3Dmol>=1.8
jupyterlab>=3.4
notebook>=6.4
ipywidgets>=8.0
xlrd>=2.0
openpyxl>=3.0
rdkit
matplotlib>=3.5
