mdommett Goto Github PK

2hcvs2hp

For data analysis

blogdown_source

compchem-scripts

A repository for the scripts that I find useful when dealing with computational chemistry data from gaussian/turbomole/tinker etc packages. Some scripts are a lot cleaner/more user friendly than others. I will try to fix them when I have some time

deep-learning-book

Repository for "Introduction to Artificial Neural Networks and Deep Learning: A Practical Guide with Applications in Python"

exciton_coupling

Various methods to calculate the excitonic coupling in molecular pairs

facebook-group-scrape-python

Beginner project scraping a private facebook group with python

final_figure

fromage

Framework for Molecular Aggregate Excitation

markdown_readme

Markdown - you can mark up titles, lists, tables, etc., in a much cleaner, readable and accurate way if you do it with HTML.

mdommett.github.io

mysql_example

optimization-python

General optimization (LP, MIP, QP, continuous and discrete optimization etc.) using Python

smact

Python package to aid materials design

thesis

thesis_relink

titanic

Titanic data analysis from kaggle. exploratory analysis and initial models are in Initial.ipynb, final model submission in Final.ipynb. Enjoy