Job Description
Job Description Core Focus: Bridge organic chemistry and software engineering by curating chemical structure data, building automated Python pipelines, and developing cheminformatics workflows for drug discovery and AI/ML initiatives.
Key Workstreams:
- Perform data curation, standardization (tautomers, stereochemistry, salts), and quality control for chemical datasets and compound registration systems.
- Design and develop Python applications, APIs, and scalable data pipelines using tools like RDKit or ChemAxon.
- Compute molecular properties, perform substructure/similarity searches, and prepare feature datasets for predictive modeling
- Cross-Boundary Collaboration: Partner closely with medicinal chemists, data scientists, and informatics teams to translate complex scientific requirements into reliable technical solutions.
- Requirements: Master's degree or PhD in Chemistry, Cheminformatics, Computational Chemistry, or Computer Science (with strong chemistry background); professional experience in Python development and cheminformatics toolkits (RDKit, etc.).