JFChen3

ambermini

A stripped-down set of just antechamber, sqm, and tleap.

amino_acid_analysis

Package for plotting and comparing epsilons of different contact types

benchmark_tests

Jupyter Notebooks and datasets for benchmarking materials property prediction methods

chbe343

Data analysis scripts for CHBE 343 Lab

ece408_project

kinetics_scripts

Stuff for chemical kinetics calculations

tmatrix_analysis

Scripts for analyzing transition matrix data

Strigolactone-Apo-Activation

This repository contains data analysis scripts used for the strigolactone apo activation paper.

Strigolactone-Binding-JBC2021

This repository contains data analysis scripts used for the strigolactone binding paper.

Strigolactone-Hydrolysis

Code used for simulation setup and data analysis for the strigolactone hydrolysis paper

JFChen3/benchmark_tests

Jupyter Notebooks and datasets for benchmarking materials property prediction methods

JFChen3/kinetics_scripts

Stuff for chemical kinetics calculations

JFChen3/tmatrix_analysis

Scripts for analyzing transition matrix data

JFChen3/ambermini

A stripped-down set of just antechamber, sqm, and tleap.

JFChen3/amino_acid_analysis

Package for plotting and comparing epsilons of different contact types

JFChen3/chbe343

Data analysis scripts for CHBE 343 Lab

JFChen3/ece408_project

JFChen3/langevin_model

1-D Langevin dynamics simulator

JFChen3/matminer

data mining for Materials Science

JFChen3/PyEMMA

Python API for Emma's Markov Model Algorithms