Phenix ready to use in scipion.
Project description
Wrapper to use Phenix in Scipion. Supports `Phenix-1.13 <https://www.phenix-online.org/download/nightly_builds.cgi>`_ . So far we have implemented:
* emringer
* real_space_refinement
* molprobity
* superpose pdbs
INSTALLATION
1. Install `Phenix-1.13 <https://www.phenix-online.org/download/nightly_builds.cgi>`_
2. Add the path to ~/.config/scipion/scipion.conf (yours might look different, please check your Phenix path).
``PHENIX_HOME=/usr/local/phenix-1.13-2998``
3. Install scipion-em-phenix
a) In user mode:
``scipion installp -p scipion-em-phenix``
b) In developer mode:
``scipion installp -p /path/to/scipion-em-phenix --devel``
TESTS:
* scipion test phenix.tests.test_protocol_emringer
* scipion test phenix.tests.test_protocol_real_space_refine
* scipion test phenix.tests.test_protocol_molprobity
* scipion test phenix.tests.test_protocol_superpose_pdbs
![alt text](http://arquimedes.cnb.csic.es:9980/badges/phenix_devel.svg)
Builbot_URL: http://arquimedes.cnb.csic.es:9980/#/builders/25
* emringer
* real_space_refinement
* molprobity
* superpose pdbs
INSTALLATION
1. Install `Phenix-1.13 <https://www.phenix-online.org/download/nightly_builds.cgi>`_
2. Add the path to ~/.config/scipion/scipion.conf (yours might look different, please check your Phenix path).
``PHENIX_HOME=/usr/local/phenix-1.13-2998``
3. Install scipion-em-phenix
a) In user mode:
``scipion installp -p scipion-em-phenix``
b) In developer mode:
``scipion installp -p /path/to/scipion-em-phenix --devel``
TESTS:
* scipion test phenix.tests.test_protocol_emringer
* scipion test phenix.tests.test_protocol_real_space_refine
* scipion test phenix.tests.test_protocol_molprobity
* scipion test phenix.tests.test_protocol_superpose_pdbs
![alt text](http://arquimedes.cnb.csic.es:9980/badges/phenix_devel.svg)
Builbot_URL: http://arquimedes.cnb.csic.es:9980/#/builders/25
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scipion-em-phenix-1.0.2.tar.gz
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