Postdoctoral researcher in @bigginlab. Keen on computational chemistry, biophysics, machine learning, and education.
- Boulder
- weitsehsu.com
- @WeiTseHsu
Highlights
- Pro
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icomse/3rd_workshop_advanced_sampling
icomse/3rd_workshop_advanced_sampling PublicMaterial for the 3rd i-CoMSE Workshop: Methods for Advanced Sampling
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boltzmann_generators
boltzmann_generators PublicA repository for the final project implementing/applying Boltzmann generators for Computational Statistical Physics (PHYS 7810) at CU Boulder
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ensemble_md
ensemble_md PublicA python package for performing GROMACS simulation ensembles
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enhanced_sampling_tutorials
enhanced_sampling_tutorials PublicA repository providing jupyter notebooks and simulation inputs that accompany the mini course Hands-on tutorials: Advanced sampling methods using GROMACS
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REMD_analysis
REMD_analysis PublicA repository for the development of data analysis tools for replica exchange molecular dynamics (REMD) simulations
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alchemical_metadynamics
alchemical_metadynamics PublicA repository for maintaining the simulation files and analysis codes for the JCTC paper of alchemical metadynamics
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