/pistache_predictor

ChEMBL Multitask Model C++ REST microservice with ONNX Runtime and Pistache

Primary LanguageC++MIT LicenseMIT

Target prediction C++ REST microservice with ONNX Runtime, RDKit and Pistache

ChEMBL Multitask Model C++ REST microservice with ONNX Runtime and Pistache. Molecular fingerprints calculated with RDKit.

To run it

Build the Docker image and run a container

docker-compose up -d

Query the service:

curl --request POST -d "Cc1ccccc1-c1ccc(C=NNC(=O)CCCCCC(=O)NO)cc1" http://localhost:9080/predict

To stop and delete the running container

docker-compose down