Cheminformatics jobs

Lead computational chemistry contributions to drug programmes from early discovery towards candidate selection. Combine structure-based and ligand-based design with AI predictions, work closely with machine-learning scientists and experimental teams, and guide external research activities. The role includes scientific leadership and mentoring. The…

Build machine-learning and computational-chemistry software supporting molecular property prediction, virtual screening, reaction optimisation and drug design. Work spans production pipelines and methods such as molecular dynamics, docking, free-energy calculations and retrosynthesis, in collaboration with discovery scientists. The advertised salary range…

EMBL-EBI seeks a scientific developer for the Open Targets Safety 2.0 project. The role builds machine-learning and data-processing pipelines that extract drug side-effect evidence from publications, clinical trials and drug labels, map it to biomedical ontologies, and integrate results with ChEMBL and the Open Targets Platform. The researcher will help…