JACoW is a publisher in Geneva, Switzerland that publishes the proceedings of accelerator conferences held around the world by an international collaboration of editors.
TY - CONF AU - Perl, D.P. AU - Frisina, N. AU - Oram, D.E. AU - Paterson, N.P. ED - Schaa, Volker RW ED - Götz, Andy ED - Venter, Johan ED - White, Karen ED - Robichon, Marie ED - Rowland, Vivienne TI - Ultra-High Throughput Automated Macromolecular Crystallography Data Collection Using the Bluesky Framework J2 - Proc. of ICALEPCS2023, Cape Town, South Africa, 09-13 October 2023 CY - Cape Town, South Africa T2 - International Conference on Accelerator and Large Experimental Physics Control Systems T3 - 19 LA - english AB - At Diamond Light Source, several Macromolecular Crystallography (MX) beamlines focus on, or include, completely automated data collection. This is used primarily for high throughput collection on samples with known or partially known structures, for example, screening a protein for drug or drug fragment interactions. The automated data collection routines are currently built on legacy experiment orchestration software which includes a lot of redundancy originally implemented for safety when human users are controlling the beamline, but which is inefficient when the beamline hardware occupies a smaller number of known states. Diamond is building its next generation, service-based, Data Acquisition Platform, Athena, using NSLSII’s Bluesky experiment orchestration library. The Bluesky library facilitates optimising the orchestration of experiment control by simplifying the work necessary to parallelise and reorganise the steps of an experimental procedure. The MX data acquisition team at Diamond is using the Athena platform to increase the possible rate of automated MX data collection both for immediate use and in preparation to take advantage of the upgraded Diamond-II synchrotron, due in several years. This project, named Hyperion, will include sample orientation and centring, fluorescence scanning, optical monitoring, collection strategy determination, and rotation data collection at multiple positions on a single sample pin. PB - JACoW Publishing CP - Geneva, Switzerland SP - 1280 EP - 1284 KW - experiment KW - software KW - controls KW - data-acquisition KW - hardware DA - 2024/02 PY - 2024 SN - 2226-0358 SN - 978-3-95450-238-7 DO - doi:10.18429/JACoW-ICALEPCS2023-THMBCMO34 UR - https://jacow.org/icalepcs2023/papers/thmbcmo34.pdf ER -