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Achievement: Pair ExtraordinaireAchievement: StarstruckAchievement: Pull Sharkx2Achievement: YOLOAchievement: Quickdraw

Achievements

Achievement: Pair ExtraordinaireAchievement: StarstruckAchievement: Pull Sharkx2Achievement: YOLOAchievement: Quickdraw

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lexin-chen/README.md

Welcome, I'm Lexin👋

Computational Chemistry | Software Development | Machine Learning

🔬 computational chemist focused on high-performance algorithms for scientific discovery

⚡ Architected MDANCE: Novel clustering engine with >25x speedup for million-scale molecular libraries

🧠 ML for Drug Discovery: Built DELight framework to solve extreme class imbalance in screening data

🏭 Industry Experience: Enhanced Schrödinger's Glide docking software, improving reliability

🎨 I am also an artist & animator of biomolecules.

Skills: Python, Cheminformatics, ML, HPC, Molecular Dynamics

📫 Let's connect: My Website

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  1. mqcomplab/MDANCE mqcomplab/MDANCE Public

    MDANCE: O(N) clustering for molecular dynamics. Process 1.5M frames in 40min. 8 specialized algorithms.

    Python 96 10

  2. mqcomplab/PRIME mqcomplab/PRIME Public

    protein structure prediction with precision

    Python 26 1

  3. mqcomplab/DELight mqcomplab/DELight Public

    targeted undersampling strategy for DEL

    Python 14

  4. md-starters md-starters Public

    setup/analysis of molecular dynamics simulations for membrane proteins

    Python 6

  5. mqcomplab/SIE_descriptors mqcomplab/SIE_descriptors Public

    quantifying specific ion effects through charge transfer models

    Python 6 2

  6. SciArt SciArt Public

    aesthetic 3D images of biomolecules on Blender

    Tcl 3