bas-rustenburg Goto Github PK

ace

Admission to candidacy exam.

ace-presentation

Working on presentations for the ACE exam

adaptivedesignprocedure

A design procedure of the training data for Machine Learning algorithms able to iteratively add datapoints according to function discrete gradient

bayesian-itc

Python tools for the analysis and modeling of isothermal titration calorimetry (ITC) experiments.

cbio-poster

conda-recipes

conda build recipes for the Omnia project

constph-openmm

OpenMM testbed for constant-pH methodologies.

docco

Literate Programming can be Quick and Dirty.

glenmorangie

This is a test repo!

her2

HER2 mutants

host-guest

Host-guest system data and simulations

host-guest_pipeline

itctools

Tools for setting up ITC experiments in an automated fashion using the Tecan EVO and Auto-iTC 200.

jsmol-local

An example of how to set up jsmol locally on a webpage.

latex-manuscript-template

Simple LaTeX manuscript template

latex_docs

LaTeX documents

litcoffee-examples

A repository of examples in Literate CoffeeScript

mathslax

Slack plugin to render math using MathJax

mdtraj

A modern, open library for the analysis of molecular dynamics trajectories

movie-templates

Jinja2 templates for pymol movie scripts

openmm

OpenMM is a toolkit for molecular simulation using high performance GPU code.

openmmtools

Test systems for OpenMM

openmoltools

An open set of tools for automating tasks relating to small molecules

peanut

presentations

A collection of presentations I have given.

prezto

The configuration framework for Zsh

projecteuler

Place for me to store my Project Euler solutions. https://projecteuler.net

pyzacros

Python library to handle KMC codes.

qbiosub

Bas and Hyunwoo's Secret Project

robots

Chodera lab automation scripts (currently private, will move to public)