Quarantine@Home is a project that lets you donate your spare computer power to finding drugs to target the coronavirus! We leverage the power of the Autodock suite of tools to perform small molecule screening against viral proteins. Possible drugs are sourced from the Zinc Database hosted at the University of California San Francisco
Developers can access the source code here
Fetch code
git clone https://github.com/cjmielke/quarantineAtHome && cd quarantineAtHome
With and Nvidia GPU (requires nvidia-docker2)
sudo docker build -t quarantinegpu -f Dockerfile.gpu . && sudo nvidia-docker run -it -e ME=anonymous quarantinegpu
CPU only (slower)
sudo docker build -t quarantine -f Dockerfile . && sudo docker run -it -e ME=anonymous quarantine