A JSON API for calculating open source molecular descriptors. Currently exposes a subset of the molecular descriptors in the Chemistry Development Kit.
Some examples using curl, presuming the service is running locally on port 3000.
GET a list of available descriptors:
curl http://localhost:3030
Calculate the descriptors for a Molfile named "caffeine.mol":
curl --form "molfile=<caffeine.mol" http://localhost:3030
You will need Leiningen 1.7.0 or above installed.
To start a web server for the application, run:
lein ring server
See LICENSE.txt