DATA SCIENCE · MOLECULAR ML · LAB AUTOMATION

Your Name

Data Scientist — ML for Chemistry & Pharma

I build machine learning systems that predict molecular properties and turn raw lab instrument data into production-ready reports — end to end, mostly solo.

01In Production

LCMS Automation Platform

Turns raw mass-spec instrument files into analysis-ready reports, automatically, for dozens of scientists a day.

Visual proof goes here

Add a screenshot, architecture diagram, or short demo clip for “LCMS Automation Platform” — replace /projects/lcms-visual.svg in content/site-data.json.

Tens
of scientists using it daily
~100
scientist scale target
5+
concurrent users supported
3
output formats, one pipeline
PythonThreadPoolExecutor / ProcessPoolExecutorpandasCherryPyAWS EC2Custom binary parsersrainbownmrglue
02In Progress

Agentic AI System

An agent-driven pipeline that adapts to unpredictable lab-report layouts instead of relying on one fixed template.

Visual proof goes here

Add a screenshot, architecture diagram, or short demo clip for “Agentic AI System” — replace /projects/agentic-visual.svg in content/site-data.json.

LLM agentsPythonDocument layout parsingPrompt orchestration
03Planned

[Project 3 — add a title]

[One punchy line summarizing the project, 10–15 words.]

Visual proof goes here

Add a screenshot, architecture diagram, or short demo clip for “[Project 3 — add a title]” — replace /projects/project-three-visual.svg in content/site-data.json.

[#]
[what this number measures]
[Tech 1][Tech 2][Tech 3]
Skills

The stack behind the work

ML / AI

  • Molecular property prediction (ADMET, permeability)
  • AutoML
  • Spectral classification (FTIR)
  • Cheminformatics
  • LLM agents & prompt orchestration
  • scikit-learn / XGBoost

Backend

  • Python
  • CherryPy
  • REST API design
  • Concurrent & parallel processing

Infra

  • AWS EC2
  • ThreadPoolExecutor / ProcessPoolExecutor
  • PyInstaller packaging
  • Deployment & monitoring

Tools

  • pandas / NumPy
  • rainbow (Waters .raw)
  • nmrglue (NMR)
  • Tkinter
  • Excel / Word report generation
  • Git
ABOUT

Machine learning, grounded in the lab.

I'm a data scientist working at the intersection of machine learning and pharmaceutical chemistry — building models that predict molecular properties and systems that automate the lab data pipelines chemists rely on every day.

I started as a data science intern in 2024, working on AutoML for ADMET property prediction, and converted to a full-time role after six months. Since then I've built and shipped most of these projects solo, end to end — from raw instrument files to production systems used by dozens of scientists.

Experience

  1. 2024 (PPO conversion) – Present

    Data Scientist

    [Company Name]

    Own ML and lab-automation projects end to end: molecular property prediction, spectral classification, and the LC-MS automation platform.

  2. 2024

    Data Science Intern

    [Company Name]

    Built an AutoML pipeline for ADMET property prediction; converted to full-time after six months.

Education

[Year]

[Your Degree]

[Your Institution]

© 2026 — Built with Next.js, Tailwind CSS & Framer Motion.