We are the only AI-native biotech, pioneering small and large molecule therapeutics discovery by integrating massive multimodal data, frontier AI models, and high-throughput lab automation into an infrastructure for AI-enabled drug discovery. Join us to build the world’s first AI infrastructure for tech-enabled drug discovery and to deliver a pipeline of diverse drug modalities for all major disease areas.
Requirements
- Ph.D. in computational chemistry or related discipline
- In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches
- Molecular dynamics (MD) simulations, including both standard MD and enhanced sampling techniques such as metadynamics, umbrella sampling, and replica exchange MD
- Free energy simulations such as FEP and TI, and QM/MM methodologies for small and large molecular systems
- Proficiency in analyzing molecular properties such as solvation free energy, dipole moments, vibrational frequencies, electrostatic potential, charge distribution, and more
- Deep knowledge of implicit and explicit solvent models, with extensive experience modeling solvent effects on molecular systems and chemical reactions in various environments
- Extensive experience in using and troubleshooting software tools for QC calculations, MD simulations, Drug Design Development Packages, and HPC Clusters and cloud-based services
- Ability to optimize computational simulation protocols for efficient resource usage
- Proven experience working with small organic molecules and large biomolecular systems (e.g., peptides, proteins, etc.) for property prediction, conformational analysis, and structure-activity relationships (SAR)
- Hands-on experience with Python and Bash scripting for automating workflows and data analysis
- Familiarity with cheminformatics toolkits such as RDKit for molecular property prediction and data management
- Basic knowledge of machine learning (ML) techniques applied to molecular property prediction, virtual screening, and related tasks
Benefits
- Competitive compensation package
- Above market benefits
- Generous vacation and parental leave
- Super cool team building activities
