Matomo Code

Reaction Explorer

PROJECT DESCRIPTION

Reaction explorer is an python application that helps in learning organic chemistry by emulating reactions, syntheses and mechanisms in organic chemistry. 

 

Features Implemented in Reaction Explorer

  • This application was developed using technologies like Python, OpenEye Python Toolkit, Marvin Applets and PostgreSQL
  • There are 3 steps in this application: Single-Step Reaction Completion, Multi-Step Synthesis Design and Arrow-Pushing Mechanism Diagrams. we have improved all these three steps
  • Database improvements like optimizing database, implementing OOPs approach in code and framework like SQLAlchemy that follows NoSQL approach
  • Improved Chemistry processing algorithms like, caching calculated results
  • Improved output rendering using templating languages

 

WHAT WE DID

  • Algorithm Implementation 95% 95%
  • Database Tuning 97% 97%
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