Deliverables
Risk and Data Management Plan; updates
Documentation material of the version 1 (v1) of the platform, and platform pre-release for audit by WP5
Risk and Data Management Plan; updates
Report on central infrastructure setup including central services (container registries, CI/CD pipelines, GPU acceleration, and partner cluster networking)
Risk Management Plan; updates (M3, 12, 24)
Initial Project communication plan and toolset; updates
Data preparation manual, one version for each run (M6, 18, 29)
Data Management Plan; updates (M3, 12, 24)
Data preparation manual, one version for each run
Project Management Plan
Description of transversal coordination process and agile method for IT development cycle
Documentation material of the version 2 (v2) of the platform, and platform pre-release for audit by WP5
Final release of structure processing script, one version for each run (M7, 19, 29)
Prototype of based test-train fold splitting algorithm ready for integration in WP4 ML software. One for prototype for 2nd and 3rd federated run each (M18, 29)
Locality-sensitive hashing based test-train fold splitting code deployed at the pharma partners
Final release of structure processing script, one version for each run
Initial Project communication plan and toolset; updates (M12, 24, 36)
Searching for OpenAIRE data...
Publications
Author(s): Martijn Oldenhof, Adam Arany, Yves Moreau, Jaak Simm
Published in: Journal of Chemical Information and Modeling, Issue 60/10, 2020, Page(s) 4506-4517, ISSN 1549-9596
DOI: 10.1021/acs.jcim.0c00459