Principal Scientist, Computational Chemistry
Tasks
- Build augmented computational strategy
- Collaborate with medicinal chemistry discovery biology discovery technologies
- Design molecular libraries
- Develop QSAR models
- Develop generative design processes
- Drive research portfolio
- Enhance hit to lead and lead optimization
- Establish computational chemistry strategy
- Implement reaction prediction algorithms
- Lead computational chemistry efforts
- Lead hit finding to lead optimization workflows
- Leverage CROs and collaborators
- Mentor medicinal chemists
- Perform molecular dynamics
- Perform molecular modeling
- Perform structure guided drug design
- Provide hands on computational chemistry guidance
Perks/Benefits
- N/A
Skills/Tech-stack
Active Learning | Alphafold | Cheminformatics | Cloud Computing | Computational Chemistry | DMPK | De Novo | De novo design | Drug design | FEP | Generative Design | Library design | Ligand-Based Design | MOE | Medicinal Chemistry | Molecular Dynamics | Molecular Modeling | Molecular simulation | Python | QSAR | R | Reaction prediction | Schrödinger | Structure-Based Drug Design | Structure-based modeling
Education
Roles
Chemist | Computational Chemist | Principal | Principal Scientist | Scientist
Regions
Countries
States
Related jobs
-
Data Scientist - TikTok Social and Creation (San Jose) USD 144K-332KA/B | A/B Testing | B testing | Causal Inference | Data AnalysisEntry-level Full TimeSan Jose, California, United States13h ago
-
Mid-level Full TimeUSA MD Fort George G Meade …1d ago
-
Data Scientist, Senior (TS/SCI w/ Poly) USD 125K-225KAI | AWS | Cassandra | Data Compliance | Data GovernanceSenior-level Full TimeUSA MD Columbia (Field), United States1d ago
-
Principal AI Architect - Agentic Verticals USD 206K-451KC++ | Computer Vision | Hugging Face | Java | LangchainHybrid workSenior-level Full TimeSeattle (WA), United States1d ago
-
Data Analytics – A/B Testing in Minneapolis, MN USD 142K-155KA/B | A/B Testing | AWS | Alteryx | Azure401-k match | Adoption Assistance | Dental insurance | Employer retirement plan | Healthcare benefitsMid-level Full TimeMinneapolis, MN, United States1d ago
-
Applied Scientist USD 80K-218KAWS | Agentic Systems | Artificial Intelligence | Azure | Cloud DevelopmentAccess to Headspace app | Career development | Employee assistance program | Employee stock purchase plan | Fitness reimbursementMid-level Full TimeUnited States of America, Eagan, Minnesota R1d ago
-
Data Science and Forecasting Lead USD 96K-192KARIMA | Business Intelligence | Data Visualization | Excel | ForecastingDependent care spending account | Health care spending account | Health savings account | Long-term disability | Medical/Dental/VisionSenior-level Full TimeCAFLO: Carrier-Home Florida Remote Location, Remote … R1d ago
-
Data Scientist, People & Workforce Analytics USD 80K-110KAI Agents | Data Lake | Data cleaning | Deep learning | Feature EngineeringFull benefits package | Paid Holidays | Paid time offMid-level Full TimePA Philadelphia, United States R1d ago
-
Senior-level Full TimeRENSS - GLOBAL VIEW, United States1d ago
-
Intern, Data Scientist - Summer 2026 USD 50K-50KAPIs | Agent-based | Agent-based architecture | Cloud Computing | Data Analysis401k match | Health savings account | Life insurance | Medical/Dental/Vision insurance | Paid HolidaysEntry-level Full Time InternshipAriens BW Office Building (The Foundry), …1d ago
-
Principal Data Scientist, Operations USD 183K-224KApache Airflow | Code review | DVC | Kubernetes | MLflow401k company match | Dental insurance | Flexible schedule | Flexible spending account | Generous PTOSenior-level Full TimeRemote, United States R1d ago
-
Data Scientist USD 123K-195KArtificial Intelligence | Cloud Computing | Data Ingestion | Data Visualization | Data cleaningSenior-level Full TimeTampa, FL1d ago
-
Principal Data Scientist USD 157K-212KA/B | A/B Testing | B testing | Bayesian estimation | Boosted Trees401k | Dental insurance | Employee wellness program | Flexible spending account | Flexible time offSenior-level Full TimeSan Francisco, CA1d ago
-
Applied Research Scientist - Foundation Models USD 140K-175KC++ | CNN | Computer Vision | Fine Tuning | Image Text401k | Dental insurance | Employee assistance program | Flexible time off | Health insuranceSenior-level Full TimeRedwood City1d ago
-
Data Scientist USD 100K-150KData Visualization | Machine Learning | Python | R | Statistical modelingMid-level Full TimeLos Angeles, CA1d ago
-
Data Scientist, Strategic Finance USD 230K-385KCausal Inference | Customer Segmentation | Dashboarding | Data Analysis | Data EngineeringHybrid work model | Relocation assistanceSenior-level Full TimeSan Francisco1d ago
-
Staff Data Scientist, Algorithm - Growth USD 250K-299KBatch pipelines | Causal Inference | Cloud services | Data Modeling | Dimensional ModelingSenior-level Full TimeUS - San Francisco1d ago
-
Staff Data Scientist, Growth Analytics USD 180K-300KCause analysis | Data Modeling | Data Science | Data analytics | ExperimentationSenior-level Full TimeUS - San Francisco1d ago
-
Computer Vision Scientist (multiple levels/openings) USD 160K-220KC++ | Computer Vision | Deep learning | Image classification | Machine Learning401k matching | Commuter benefits | Dental coverage | Employee referral program | Flexible spending accountsSenior-level Full TimeSanta Clara, CA1d ago
-
Data Scientist USD 150K-190KAirflow | Artificial Intelligence | Bash | CI/CD | Cause analysisDaily catered lunches | Modern office | Professional development | Technology talksEntry-level Full TimeBerkeley, CA1d ago
-
Computer Vision | Deep learning | High Degree of Freedom Manipulation | Human robot | Human-Robot Interaction401k match | Dental insurance | Flexible PTO | Green card sponsorship | H1B sponsorshipSenior-level Full TimeSan Francisco1d ago
-
Data Scientist (L5) - Ads (Experimentation) USD 372K-600KAuction theory | Causal Discovery | Causal Inference | Experimental Design | Machine Learning401k match | Disability insurance | Family-forming benefits | Flexible spending account | Flexible time offSenior-level Full TimeUSA - Remote, United States R2d ago
-
Data Science Intern - AI Focus USD 53K-89KAgents | Artificial Intelligence | Data Modeling | ETL | EmbeddingsEntry-level InternshipUSA-VA-Herndon2d ago
-
Data Scientist USD 160K-225KAWS | Azure | BigQuery | DBT | GCPCommuter benefits | Company meals | Dental insurance | Health insurance | Paid parental leaveMid-level Full TimeNew York2d ago
-
Research Data Scientist, Ads Insight and Measurement USD 147K-211KData Analysis | Data Modeling | Exploratory Data Analysis | High Dimensional Statistics | Machine LearningMid-level Full TimeMountain View, CA, USA; New York, …2d ago