# westpa_tutorials

**Repository Path**: chenbq479/westpa_tutorials

## Basic Information

- **Project Name**: westpa_tutorials
- **Description**: Tutorials and additional documentation for the WESTPA suite
- **Primary Language**: Unknown
- **License**: Not specified
- **Default Branch**: master
- **Homepage**: None
- **GVP Project**: No

## Statistics

- **Stars**: 0
- **Forks**: 0
- **Created**: 2021-12-17
- **Last Updated**: 2021-12-17

## Categories & Tags

**Categories**: Uncategorized

**Tags**: None

## README

# Suite of WESTPA tutorials: Supplementary information
This collection of files is a companion to the Suite of WESTPA tutorials. Each tutorial directory contains
all files necessary for completing that tutorial. Programs such as WESTPA, Amber, Python etc. will need to be 
installed by the user and are not provided herein. The following is a list of all tutorials with their 
classification.

## Beginner tutorial

Na+/Cl- molecular association

## Intermediate tutorial

P53 peptide conformational sampling

## Advanced tutorials

Chignolin protein folding

WExplore K+ 18-crown-6-ether association

## Analysis tutorials

Calculating progress coordinates using MDAnalysis/MDTraj

The w\_ipa suite of analysis tools

Dataset visualization and movie-making