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DIALS: Diffraction Integration for Advanced Light Sources

Code style: black Coverage Gitter

X-ray crystallography for structural biology has benefited greatly from a number of advances in recent years including high performance pixel array detectors, new beamlines capable of delivering micron and sub-micron focus and new light sources such as XFELs. The DIALS project is a collaborative endeavour to develop new diffraction integration software to meet the data analysis requirements presented by these recent advances. There are three end goals: to develop an extensible framework for the development of algorithms to analyse X-ray diffraction data; the implementation of algorithms within this framework and finally a set of user facing tools using these algorithms to allow integration of data from diffraction experiments on synchrotron and free electron sources.

Website

https://dials.github.io

Reference

Winter, G., Waterman, D. G., Parkhurst, J. M., Brewster, A. S., Gildea, R. J., Gerstel, M., Fuentes-Montero, L., Vollmar, M., Michels-Clark, T., Young, I. D., Sauter, N. K. and Evans, G. (2018) Acta Cryst. D74.

Funding

DIALS development at Diamond Light Source is supported by the BioStruct-X EU grant, Diamond Light Source, and CCP4.

DIALS development at Lawrence Berkeley National Laboratory is supported by National Institutes of Health / National Institute of General Medical Sciences grant R01-GM117126. Work at LBNL is performed under Department of Energy contract DE-AC02-05CH11231.

DIALS's Projects

annlib icon annlib

ANN: A Library for Approximate Nearest Neighbor Searching

bitshuffle icon bitshuffle

Filter for improving compression of typed binary data.

blog icon blog

Experimental repository

boost icon boost

Boost release copies historically used in DIALS releases. Contains release tags and is retained for historic bootstrap scripts only.

cbflib icon cbflib

Copy of upstream cbflib repository with DIALS release tags

cctbx icon cctbx

Mirror of the cctbx repository, automatically tracking stable commits on master, and additionally used for branching DIALS releases

clipper icon clipper

As of DIALS 3.2 we no longer distribute clipper headers

data icon data

DIALS Regression Data Manager

data-files icon data-files

Repository containing data files for dials-data

dials icon dials

Diffraction Integration for Advanced Light Sources

dials-rest icon dials-rest

A RESTful API to a (limited) subset of DIALS functionality

dials.github.io icon dials.github.io

The DIALS website, autogenerated from source daily via Jenkins at Diamond Light Source

dxtbx icon dxtbx

Diffraction Experiment Toolbox

eigen icon eigen

As of DIALS 3.1 we no longer distribute eigen

hdf5plugin icon hdf5plugin

A repository for HDF5 Plugin filters, using HDF5 > 1.8.11

iota icon iota

IOTA: Integration Optimization, Triage and Analysis (DIALS release branches)

isis_utils icon isis_utils

Additional methods outside of the DIALS workflow for working with ISIS neutron diffraction data

kb icon kb

DIALS community knowledge base

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