mispr 0.0.2

# <img alt=”mispr” src=”docs/logo.png” width=”500”>

# MISPR: Materials Informatics for Structure-Property Relationships

Rasha Atwi, Matthew Bliss, Maxim Makeev, and Nav Nidhi Rajput

Stony Brook University

# Table of Contents

# Introduction MISPR is a software that executes, manages, and stores computational materials science simulations. It contains pre-defined DFT and MD workflows to calculate and analyze different properties of materials.

• Source: https://github.com/molmd/mispr

# Installation

# Requirements

# Usage

# Citation If you find MISPR useful in your research, please consider citing the following paper.