Computational Chemistry / Theory Consultant
$312,000–$416,000 year
HybridEmeryville, California, United States
Job Summary
Model electrostatic actuation using Poisson–Boltzmann, explicit-ion molecular dynamics, or continuum methods to predict voltage–displacement and force behavior. Simulate nanomechanics of the charged DNA-origami plate, force transmitter, and amplifying linkage to capture coupled electro-mechanical responses. Predict single-molecule fluorescence distances, structural geometry for cryo-EM comparison, operational force-distance-voltage surfaces, and surface-attachment energetics to provide a quantitative theoretical baseline for the experimental team. Deliver prediction-versus-measurement comparison reports that flag deviations and guide design iterations. Report to Dr. Jeremy Barton on a contract basis with hybrid availability in Emeryville, CA.
Required Qualifications
- PhD-level expertise in molecular simulation and interfacial electrostatics (e.g., Poisson–Boltzmann, explicit-ion molecular dynamics, or continuum methods) and in nanomechanics, ideally at bio–inorganic interfaces
- Judgment about which method fits which question — in particular, when coarse-grained structural models are and are not adequate for electrostatics
- Demonstrated experience predicting experimental observables (fluorescence, force spectroscopy, electrostatics) and validating them against measurement
- Availability for a project-based contract engagement from the program's start, working closely with the design and device-physics leads
- Some travel may be required from time-to-time for in-person collaboration and work
Desired Qualifications
- ideally at bio–inorganic interfaces
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