From 7d33a710ce4999a87af219de153d586d082dd2c6 Mon Sep 17 00:00:00 2001 From: Assmann Greta Marie Date: Thu, 2 May 2024 16:43:11 +0200 Subject: [PATCH] change README --- README.md | 31 ++++--------------------------- 1 file changed, 4 insertions(+), 27 deletions(-) diff --git a/README.md b/README.md index 09de739..3e9cad1 100644 --- a/README.md +++ b/README.md @@ -1,29 +1,6 @@ -# Vespa data processing pipeline -Author: G.Assmann (2023) \ -Vespa data processing (VDP) - -This Pipeline was generated to run spot finding, indexing and integration of VESPA h5 files with crystfel (https://www.desy.de/~twhite/crystfel) in an automated manner.All files inlcuding "vdp" belong to this pipeline. - -An additional merging automation (VDM) was also included, files including "vdm" for VESPA data merging belong to this pipeline. The same conda env is needed as for VDP. The user can choose run numbers that are supposed to be merged; obvoiusly they should be of the same protein and spacegroup etc. So far there is no default check if the run numbers chosen are actually from the same protein - be careful! -The User can specify different timepoints that are supposed to be merged, there are two possibilities: - -- 1 timepoint --> every stream file in the corresponding folders are merged together - will result in one merging folder and one HKL file. -- X timepoints --> only streamfiles of the specific timepoint will be merged together - will result in X merging folders and in total X HKL files. Per merging folder exists only one HKL file. - -# Installation - - -source /opt/gfa/python 3.10\ -conda create --name vdp python=3.10\ -conda activate vdp - - pip install git+https://github.com/pgasparo/crystfelparser \ - pip install scipy matplotlib pandas h5py scikit-learn bitshuffle joblib seaborn ipython \ - pip install stomp.py loguru pyepics pyzmq numpy \ - pip install sseclient requests pathlib - -# Execution -Have a look into section 2. in -https://docs.google.com/document/d/11cP3m3qTd52bGmubK3JrWsMM_9QDvuo46fF4VUwqGZY/edit?usp=sharing +# CLARA data processing pipeline +Author: G.Assmann (2024) \ +## Documentation +https://gitlab.psi.ch/sf-mx/docs/-/wikis/Clara