[[ https://phenix-online.org/ | Phenix Home ]] ====== Installation ====== * Uncompress the package, enter into the folder and run ./install --prefix=/home/usr/share * For Ubuntu server, you may need to add en_GB into system ([[https://askubuntu.com/questions/76013/how-do-i-add-locale-to-ubuntu-server | ref]]) sudo locale-gen en_GB #sudo update-locale # this line may not be required ====== Benchmark ====== * On rabi; 1UBQ; phenix.fmodel * fft: 3.3s (time phenix.fmodel 1UBQ.pdb 1ubq-sf.mtz format=cns algorithm=fft file_name=fft.hkl) * direct: 5.1s (time phenix.fmodel 1UBQ.pdb 1ubq-sf.mtz format=cns algorithm=direct file_name=direct.hk) ====== Install additonal python packages for Phenix ====== * openopt: just link /home/yxue/codelib/pypkg/openopt to /home/usr/share/phenix-1.12-2829/base/lib/python2.7/site-packages * scipy (note: build-in numpy is 1.81, higher version of scipy is not recommended) cd /home/usr/share/phenix-1.12-2829/base/bin phenix.python ./pip install scipy==0.14.1 ====== Reference ====== * [[http://www.phenix-online.org/documentation/glossary.htm | Glossary of X-ray Crystallography]] * http://www.ccp4.ac.uk/ccp4bin/viewcvs/cctbx/cctbx_sources/iotbx/iotbx/mtz/Attic/writer.py?rev=1.1.1.1&content-type=text/vnd.viewcvs-markup