Computational Crystallography Toolbox (cctbx)

Computational Crystallography Toolbox

cctbx

Geek Repo

Home Page:https://cci.lbl.gov/docs/cctbx

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Computational Crystallography Toolbox's repositories

cctbx_project

Computational Crystallography Toolbox

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cctbx-playground

A playground-copy of the full CCTBX SVN repository. Nobody will mind if you break things here

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dxtbx

Diffraction Experiment Toolbox

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conda_build

Repository for building conda packages

annlib

ANN v1.1 with patches

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annlib_adaptbx

annlib_adaptbx repository

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ccp4io_adaptbx

Helper repository for ccp4io

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cctbx.github.io

The cctbx documentation, autogenerated from source daily via Jenkins at Diamond Light Source

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conda_matplotlib

For building matplotlib until main conda-forge package can be used

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conda_mrcfile

Deprecated and moved to conda-forge

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eigen

Copy of eigen from GitLab (The official repository should be used)

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gui_resources

Basic resources for CCTBX GUIs

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ncdist

ncdist is a package of two utilities built on the Niggli-Cone cell distance discussed in [Andrews, L. C., Bernstein, H. J. (2014). "The geometry of Niggli reduction: BGAOL -- embedding Niggli reduction and analysis of boundaries". Journal of applied crystallography, 47(1), 346-359.] which provides a sensitive and reliable metric for the distance between crystallographic unit cells. A shell command line program ncdist is provided as well as a shared library rcpp_ncdist for use of ncdist from R.

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nightly-feedstock

A conda-smithy repository for nightly builds of cctbx

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python3

helper repository on the effort to move cctbx to Python3 land

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staged-recipes

A place to submit conda recipes before they become fully fledged conda-forge feedstocks

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tntbx

Wrapper for TNT 1.2.2 and JAMA 1.2.1

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boost

Subset of Boost sources

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clipper

Copy of the Clipper project

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conda_hdf5_plugins

Deprecated and moved to conda-forge

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conda_procrunner

Deprecated and moved to conda-forge

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conda_py2app

Deprecated and moved to conda-forge

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ispyb-feedstock

A conda-smithy repository for ispyb.

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LatticeRepLib

Lattice Representation Library with test codes and programs for investigating spaces for 3-D lattices

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