PDB101

A collection of resources pertaining to processing 3D structural data from the Protein Data Bank

This file will become your README and also the index of your documentation.

Developer Guide

If you are new to using nbdev here are some useful pointers to get you started.

Install PDB101 in Development mode

# make sure PDB101 package is installed in development mode
$ pip install -e .

# make changes under nbs/ directory
# ...

# compile to have changes apply to PDB101
$ nbdev_prepare

Usage

Installation

Install latest from the GitHub repository:

$ pip install git+https://github.com/roshkjr/PDB101.git

or from conda

$ conda install -c roshkjr PDB101

or from pypi

$ pip install PDB101

Documentation

Documentation can be found hosted on this GitHub repository’s pages. Additionally you can find package manager specific guidelines on conda and pypi respectively.

How to use

Fill me in please! Don’t forget code examples:

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