Skip to main content
This is a pre-production deployment of Warehouse. Changes made here affect the production instance of PyPI (pypi.python.org).
Help us improve Python packaging - Donate today!

Python wrapper for the NCI Chemical Identifier Resolver (CIR).

Project Description

Introduction

CIRpy is a Python interface for the Chemical Identifier Resolver (CIR) by the CADD Group at the NCI/NIH.

CIR is a web service that will resolve any chemical identifier to another chemical representation. For example, you can pass it a chemical name and and request the corresponding SMILES string:

>>> import cirpy
>>> cirpy.resolve('Aspirin', 'smiles')
'C1=CC=CC(=C1C(O)=O)OC(C)=O'

CIRpy makes interacting with CIR through Python easy. There’s no need to construct url requests and parse XML responses — CIRpy does all this for you.

Installation

Install CIRpy using:

pip install cirpy

Alternatively, try one of the other installation options.

Documentation

Full documentation is available at http://cirpy.readthedocs.org.

Contribute

  • Feature ideas and bug reports are welcome on the Issue Tracker.
  • Fork the source code on GitHub, make changes and file a pull request.

Acknowledgements

All of CIRpy’s functionality relies on the fantastic CIR web service created by the CADD Group at the NCI/NIH.

License

CIRpy is licensed under the MIT license.

Release History

Release History

This version
History Node

1.0.2

History Node

1.0.1

Download Files

Download Files

Download the file for your platform. If you're not sure which to choose, learn more about installing packages.

File Name & Checksum SHA256 Checksum Help Version File Type Upload Date
CIRpy-1.0.2.tar.gz (20.3 kB) Copy SHA256 Checksum SHA256 Source Jan 4, 2016

Supported By

WebFaction WebFaction Technical Writing Elastic Elastic Search Pingdom Pingdom Monitoring Dyn Dyn DNS Sentry Sentry Error Logging CloudAMQP CloudAMQP RabbitMQ Heroku Heroku PaaS Kabu Creative Kabu Creative UX & Design Fastly Fastly CDN DigiCert DigiCert EV Certificate Rackspace Rackspace Cloud Servers DreamHost DreamHost Log Hosting