Feedstock license: BSD-3-Clause
Home: https://github.com/cctbx/cctbx_project
Package license: BSD-3-Clause-LBNL AND BSD-3-Clause AND BSL-1.0 AND LGPL-2.0-only AND LGPL-2.1-only AND LGPL-3.0-only AND MIT AND LGPL-2.0-or-later WITH WxWindows-exception-3.1
Summary: The Computational Crystallography Toolbox
Development: https://github.com/cctbx/cctbx_project
Documentation: https://cctbx.github.io/
The Computational Crystallography Toolbox (cctbx) is being developed as the open source component of the Phenix system. The goal of the Phenix project is to advance automation of macromolecular structure determination. Phenix depends on the cctbx, but not vice versa. This hierarchical approach enforces a clean design as a reusable library. The cctbx is therefore also useful for small-molecule crystallography and even general scientific applications.
| Azure |
|
| Name | Downloads | Version | Platforms |
|---|---|---|---|
 |
 |
 |
 |
Installing phenix from the cctbx-dev channel can be achieved by adding cctbx-dev to your channels with:
conda config --add channels cctbx-dev
conda config --set channel_priority strict
Once the cctbx-dev channel has been enabled, phenix can be installed with conda:
conda install phenix
or with mamba:
mamba install phenix
It is possible to list all of the versions of phenix available on your platform with conda:
conda search phenix --channel cctbx-dev
or with mamba:
mamba search phenix --channel cctbx-dev
Alternatively, mamba repoquery may provide more information:
# Search all versions available on your platform:
mamba repoquery search phenix --channel cctbx-dev
# List packages depending on `phenix`:
mamba repoquery whoneeds phenix --channel cctbx-dev
# List dependencies of `phenix`:
mamba repoquery depends phenix --channel cctbx-dev
If you would like to improve the phenix recipe or build a new
package version, please fork this repository and submit a PR. Upon submission,
your changes will be run on the appropriate platforms to give the reviewer an
opportunity to confirm that the changes result in a successful build. Once
merged, the recipe will be re-built and uploaded automatically to the
cctbx-dev channel, whereupon the built conda packages will be available for
everybody to install and use from the cctbx-dev channel.
Note that all branches in the phenix-project/phenix-feedstock are
immediately built and any created packages are uploaded, so PRs should be based
on branches in forks and branches in the main repository should only be used to
build distinct package versions.
In order to produce a uniquely identifiable distribution:
- If the version of a package is not being increased, please add or increase
the
build/number. - If the version of a package is being increased, please remember to return
the
build/numberback to 0.