yunhzou

University of Toronot PhD candidate 2024-2029 | Building Science Acceleration Platform atm

UWaterloo

Pinned Repositories

MLFFOpenMM
MLFF implementation from scratch with Python. For training purpose
Language:Jupyter Notebook10
AC-BO-HACKATHON-2024
Comparative Analysis of Acquisition Functions in Bayesian Optimization for Drug Discovery
Language:Jupyter Notebook00
AutomateBoringStuff
Language:Python00
OT2Demo
OT2Demo with prefect
Language:Python00
Prefect_demo
Demo files for prefect
Language:Python00
SDL-Test
Test for SDL setup with prefect
Language:Python00
test
00
WaterPIMD
PIMD for RPWater
Language:Python00
langchain
🦜🔗 Build context-aware reasoning applications
Language:Jupyter Notebook95.5k15.5k
alphafold3
AlphaFold 3 inference pipeline.
Language:Python5.3k603

yunhzou's Repositories

yunhzou/OT2Demo
OT2Demo with prefect
Language:Python
yunhzou/test
yunhzou/SDL-Test
Test for SDL setup with prefect
Language:Python
yunhzou/Prefect_demo
Demo files for prefect
Language:Python
yunhzou/AutomateBoringStuff
Language:Python
yunhzou/MLFFOpenMM
MLFF implementation from scratch with Python. For training purpose
Language:Jupyter Notebook1
yunhzou/WaterPIMD
PIMD for RPWater
Language:Python
yunhzou/AC-BO-HACKATHON-2024
Comparative Analysis of Acquisition Functions in Bayesian Optimization for Drug Discovery