Cheminformatics jobs

Research models that connect chemical structures, protein sequences and cellular transcriptomics to predict biological responses. Develop and test scientific hypotheses using large single-cell perturbation datasets, contributing new architectures and evaluations for drug discovery. The employer lists the role as on-site with at least three office days each…

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…