Chris Jones

Research Fellow at Heriot-Watt University

City of Edinburgh, Scotland, United Kingdom
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Summary

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Rockstar
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Chris Jones is a research fellow and computational materials scientist with seven years of experience applying molecular dynamics and software engineering to soft-matter and polymer physics. He develops and maintains the MoSDeF suite at Heriot-Watt, enabling reproducible simulation workflows for applications from lipid bilayers to polymer membranes and organic photovoltaics. A PhD-trained researcher from Boise State, Chris combines hands-on simulation research with open-source engineering—improving test frameworks and automation for notable projects such as the HOOMD-blue GPU MD engine. He mentors early-career researchers in workflow automation and sustainable scientific software practices, bridging multidisciplinary teams of experimentalists and modelers. Beyond modeling charge transport and self-assembly, he has a proven knack for refactoring tests and optimizing code paths that improve scientific software reliability. Based in Edinburgh, he brings a pragmatic mix of research depth and production-quality software craftsmanship to materials-science problems.
code6 years of coding experience
job7 years of employment as a software developer
bookDoctor of Philosophy - PhD, Materials Science, Doctor of Philosophy - PhD, Materials Science at Boise State University
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Github Skills (9)

pytest10
python10
molecular-simulation10
nonlinear-dynamics10
om10
testing10
simulations9
simulation9
numpy8

Programming languages (10)

TypeScriptC++ShellJavaScriptSwiftVim scriptJupyter NotebookVim Script

Github contributions (5)

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glotzerlab/hoomd-blue

Mar 2022 - Apr 2022

Molecular dynamics and Monte Carlo soft matter simulation on GPUs.
Role in this project:
userQA Engineer / Test Automation Engineer
Contributions:5 commits, 3 PRs, 3 comments in 24 days
Contributions summary:Chris focused on improving the testing framework and ensuring the correctness of the molecular dynamics simulation software. Their contributions involved refactoring existing tests, adding new unit tests, and improving the test coverage of the `hoomd-blue` library. The user's work included modifying tests related to particle filters and adjusting calls to ensure proper function execution. They also replaced specific functions with more efficient equivalents, demonstrating an understanding of code optimization within the testing context.
pythonhard-particlesimulationmonte-carlodocker
Contributions:129 pushes, 28 branches in 2 years 2 months
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