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https://github.com/samuelhoover/samuelhoover

Last synced: 17 days ago
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Host: GitHub
URL: https://github.com/samuelhoover/samuelhoover
Owner: samuelhoover
Created: 2023-05-25T14:21:58.000Z (over 1 year ago)
Default Branch: main
Last Pushed: 2024-12-31T00:21:06.000Z (24 days ago)
Last Synced: 2024-12-31T01:21:08.975Z (24 days ago)
Size: 43 KB
Stars: 0
Watchers: 1
Forks: 0
Open Issues: 0
Metadata Files:
- Readme: README.md

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README

        **Actively looking for full-time opportunities in Los Angeles, CA, USA and Vancouver, BC, CA!**\

Check out my [personal webpage](https://samuelhoover.github.io) for more details about my experience and skills.

I am a recent Chemical Engineering Ph.D. graduate from UMass Amherst and PPG Fellow. I use a variety of computational and analytical methods to study the phase behavior and self-assembly of synthetic and biological systems in the [Muthukumar Group](http://theory.pse.umass.edu). I have 6 years of hands-on experience building machine learning models and developing scientific software tools for both computational chemistry and computational biology.

### Selected projects:

- Theory for pH-responsive polyzwitterion-polyelectrolyte complexation [[Ref]](https://doi.org/10.1039/D4SM00575A)

- 3D convolutional neural networks to predict adsorption properties in nanoporous materials [[Ref]](https://pubs.rsc.org/en/content/articlelanding/2023/ta/d3ta01911j)

- Automation script for the senior lab course I have TA'ed, saved 8 hours over the course of the semester [[repo]](https://github.com/samuelhoover/ChE-401-402-peer-critiques-anonymizer)

- Ising model implemented in Rust: 1 billion steps, 2,000 x 2,000 square lattice, 6 seconds [[repo]](https://github.com/samuelhoover/ising-rust/)

### Projects in the pipeline:

- Explainable machine learning to study how monomer sequence impacts microphase behavior [in preparation]

- Atomistic, explicit solvent simulation to validate findings from [Chen, S. & Wang, Z.-G. *PNAS* 2022](https://doi.org/10.1073/pnas.2209975119)

### Languages and Tools:

[![My Skills](https://skillicons.dev/icons?i=py,rust,c,bash,pytorch,sklearn,sqlite,postgres,docker,latex,md,html,neovim,obsidian)](https://skillicons.dev)