Required Skills: Chemical Informatics, Chemistry, Computational Chemistry, Computational Sciences, Data Science, Deep Learning, Drug Design, Drug Discovery Research, High Performance Computing (HPC), Machine Learning (ML), Molecular Dynamics (MD), Molecular Modeling, Python (Programming Language), PyTorch, Quantitative Structure Activity Relationship (QSAR). Key Responsibilities: Discovery Project Support: Serve as the primary computational chemistry partner on multidisciplinary discovery teams to drive candidate design and optimization through: Design of molecules utilizing existing computational drug discovery tools and techniques (structure- and ligand-based design, molecular docking, conformational sampling, molecular dynamics, and quantum mechanics).