version: '3'
services:
  app:
    build: 
      context: .
      dockerfile: Dockerfile
      args: 
        CUDA_VERSION: 12.4.1
        # HTTPS_PROXY: http://127.0.0.1:10809
        # HTTP_PROXY: http://127.0.0.1:10809
    image: hotwa/sime:latest
    container_name: smi_mol
    volumes:
      - ../LIBRARIES:/app/SIME/LIBRARIES
    # profiles:
    #   - production
    #   - testing
    ports:
      - 5000:5000
    command: >
      micromamba run -n SIME python main.py

# docker-compose --profile production up -d
# docker-compose --profile production -f docker-compose.yml build
# docker-compose --profile production -f docker-compose.yml up -d