diffpy Goto Github PK

add2016-pdfgui

PDFgui and CMI tutorial files for the ADD2016 workshop, ILL, Grenoble

add2019-diffpy-cmi

DiffPy-CMI tutorial files for the ADD2019 workshop, ILL, Grenoble

cmi_exchange

Example scripts for the DiffPy-CMI complex modeling framework

conda-recipes

build and test recipes for conda

diffpy-release

Scripts for building binary release bundle for Linux and Mac.

diffpy.github.io

web hosting for www.diffpy.org

diffpy.labpdfproc

apps for preprocessing laboratory x-ray data before sending to pdfgetx3

diffpy.mappdf

mapPDF is a set of software scripts for automating the collection of large numbers of x-ray datasets in a high-throughput experiment. Please see the Readme below for how to use it.

diffpy.nmf_mapping

The code for the nmfMapping App on difpy-cmi

diffpy.pdffit2

real space structure refinement to atomic PDF

diffpy.pdfgui

graphical user interface for real space structure refinement to PDF

diffpy.pdfitc_api_tools

diffpy.pdfmorph

An easy way to compare PDFs.

diffpy.snmf

diffpy.srfit

framework for complex modeling and atomic structure optimization

diffpy.srmise

diffpy.srreal

Python library for PDF calculation and assortment of real-space utilities.

diffpy.srxplanar

2D integration software using pixel non-splitting algorithm

diffpy.structure

Crystal structure container and parsers for structure formats.

diffpy.test_data

diffpy.utils

General purpose shared utilities for diffpy.

fourigui

iucr2017-fayre

CMI tutorial files and examples for the IUCr 2017 software fayre, Hyderabad, India.

libdiffpy

DiffPy C++ library for calculation of PDF and other real-space quantities

libobjcryst

ObjCryst++ re-packaged for installation as a shared library

liga

Code that implements the LIGA algorithm

nsls2-pdf-school-2018

Jupyter Notebook tutorial examples for Complex Modeling and DiffPy-CMI

pyobjcryst

Python bindings to ObjCryst++ Object-Oriented Crystallographic Library

sampledb

A DB for sample and synthesis metadata information

srfit-sasview

Modules from SasView needed by srfit. SasView builds can be found here: https://jenkins.esss.dk/sasview/