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Computational Chemistry AI Evaluation Expert

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Job details

Pay

$65 USD/hr

Engagement

Contract, part-time

Location

Remote

United Kingdom only

Posted

Nov 5, 2026

OpenTrain on Trustpilot

The work

Create challenging chemistry problems based on real simulation, modeling, and reaction workflows. Review AI-generated answers and explain whether their methods and conclusions are scientifically sound.

  • Check responses for technical accuracy, reproducibility, and alignment with established chemistry practice.
  • Write structured feedback that identifies weaknesses and can help improve AI model performance.
  • Complete project tasks remotely and asynchronously.

Requirements

  • Time commitment: 20+ hours per week. The work is project-based and has no set schedule.
  • Expertise in computational, physical, or theoretical chemistry.
  • A PhD in a relevant chemistry discipline, or a master's degree combined with pharmaceutical or materials industry experience.
  • First-author publications or experience running production-scale simulation or DFT workflows.
  • Demonstrated depth in at least two of these areas is encouraged: quantum chemistry, molecular dynamics, cheminformatics, and reaction or thermodynamic modeling.
  • Strong written communication and the ability to explain complex chemistry concepts clearly.
  • Fluent written English and the ability to work independently in a remote, asynchronous setting.
  • Experience with tools such as Gaussian, ORCA, Psi4, VASP, GROMACS, LAMMPS, and RDKit is helpful. Production simulation or DFT pipeline experience in pharmaceutical, materials, or energy research is also useful.

Open to applicants in

  • United Kingdom

How to apply

  1. Press Apply now. You create a free OpenTrain account and add your resume.
  2. Finish your application on the hiring company's site. The company decides who it hires, so it runs its own form.

Job ID: cmw3tv2ie00h508lg6albwdpf

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