environment.yml

name: base
channels:
  - conda-forge
  - defaults
dependencies:
  - python=3.10
  - pip
  - rdkit
  - pandas
  - numpy
  - scipy
  - scikit-learn
  - nomkl
  - flask=2.2.5
  - werkzeug=2.2.3
  - jinja2
  - itsdangerous
  - markupsafe
  - wtforms=2.3.3
  - fastapi
  - uvicorn
  - gunicorn
  - aiofiles
  - httptools
  - uvloop
  - websockets
  - httpx
  - requests