Computational Theoretical Chemist III
Tasks
- Co author patents
- Co author peer reviewed research papers
- Improve computational hit to experimental hit process
- Integrate AI ML models into drug discovery operations
- Manage day-to-day team operations
- Mentor junior staff
- Nominate lead candidate for IND enabling studies
- Own computational chemistry programs
- Present research at conferences
- Progress virtual hit to biochemical cellular hit
- Provide computational chemistry insights for hit to lead
- Provide computational chemistry insights for lead optimization
- Represent team in senior leadership meetings
- Support development of AI ML models for drug discovery
- Teach computational chemistry principles
- Update patents with animal model data
- Validate cellular hit in animal model
Perks/Benefits
Skills/Tech-stack
Amazon Web Services | Bash | CRESSET | CREST | Charge distribution | Charge distribution analysis | Cloud Computing | Conformational sampling | Density Functional Theory | Dipole moment | Distribution analysis | Electrostatic potential | Empirical methods | Enhanced sampling | Explicit solvent | Force Fields | Free energy | Free energy perturbation | Frequency analysis | GROMACS | HPC clusters | Implicit solvent | MOE | Metadynamics | Microsoft Azure | Molecular Dynamics | Molecular conformational sampling | Molecular force fields | OpenMM | Orca | Potential energy surfaces | Python | QM/MM | Quantum Chemistry | RDKit | Replica exchange molecular dynamics | Schrödinger | Semi-empirical methods | Solvation free energy | Solvation models | Thermodynamic integration | Umbrella sampling | Vibrational frequency analysis | Web Services | XTB
Education
Roles
Regions
Countries
States
Cities
Related jobs
-
Computational Theoretical Chemist II USD 138K-214KAWS | Azure | Bash | CRESSET | CRESTGenerous vacation | Great colleagues | Parental leave | Team-building activitiesMid-level Full TimeBoston, MA1d ago
-
Computational Theoretical Chemist I USD 125K-190KAWS | Bash | CRESSET | CREST | Charge distributionGenerous vacation and parental leave | Great colleagues | Team-building activitiesSenior-level Full TimeBoston, MA1d ago
-
Computational Medicinal Chemist USD 126K-234KActive Learning | Data Visualization | Deep learning | Drug design | High Performance401k match | Comprehensive benefits package | Disability insurance | Equity awards eligible | Health insuranceSenior-level Full TimeSan Diego, United States5d ago
-
Computational Medicinal Chemist USD 126K-234KActive Learning | Biostatistics | Data Visualization | Deep learning | Drug design401k match | Disability benefits | Health benefits | Holidays and leaves | Life insuranceSenior-level Full TimeSan Diego, United States5d ago
-
Research Scientist - Computational Chemistry USD 150K-185KAlphafold | AutoDock4 | Autodock Vina | Cheminformatics | FreeSASAOn-site workSenior-level Full TimeEast Bay8d ago
-
Sr. Scientist, Computational Chemistry USD 110K-151KArtificial Intelligence | C plus plus | Cheminformatics | Data Analysis | Diversity AnalysisDental insurance | Health insurance | Medical leave | Paid Holidays | Paid caregiver/parental leaveSenior-level Full TimeUS CA San Diego, United States14d ago
-
Active Learning | Affinity prediction | Cloud Computing | Complex modeling | Computational ChemistryRelocation benefitsSenior-level Full TimeSouth San Francisco, United States20d ago
-
Principal Scientist, Computational Chemistry USD 165K-190KCheminformatics | Cheminformatics Data Formats | Data Formats | Data Pipelines | Docking401k match | Deductible Support | Family forming support | Family medical leave | Gym membershipSenior-level Full TimeBoulder, Colorado, United States27d ago