Master or phd candidate in computational chemistry
Fluency in python programming language
Experience with smiles or reaction smarts formats
The role focuses on applying computational chemistry and cheminformatics to accelerate AI-driven drug discovery at Roche
Job Summary
The role focuses on applying computational chemistry and cheminformatics to accelerate AI-driven drug discovery at Roche.
Candidates must demonstrate practical experience in either chemical representation generation or conformational sampling using high-throughput searches.
Roche fosters a culture of personal expression and open dialogue where every voice matters in the mission to prevent and cure diseases.
Matching Summary
The role focuses on applying computational chemistry and cheminformatics to accelerate AI-driven drug discovery at Roche.
Skills & Requirements
Must-have
Master or PhD candidate in Computational Chemistry
Fluency in Python programming language
Experience with SMILES or Reaction SMARTS formats
Knowledge of molecular fragmentation workflows
Understanding of organic chemistry fundamentals
Nice-to-have
Bilingual communication in Chinese and English
Experience with structure-based generative modeling
Familiarity with Machine Learning Potentials testing
Background in transition state search methods
Strong written and verbal communication skills
Key Requirements
Master or PhD degree required
Proficiency in Python toolkits
Bilingual fluency in Chinese and English preferred