Authors
Thomas O Metz, Joshua N Adkins, Peter B Armentrout, Patrick Chain, Fanny Chu, Courtney D Corley, John R Cort, Elizabeth Denis, Daniel Drell, Katherine R Duncan, Robert G Ewing, Facundo M Fernandez, Oliver Fiehn, Neha Garg, Stefan Grimme, Christopher Henry, Robert L Hettich, Tobias Kind, Roger G Linington, Gary W Miller, Trent Northen, Kirsten Overdahl, Ari Patrinos, Daniel Raftery, Paul Rigor, Richard D Smith, Jon Sobus, Justin Teeguarden, Akos Vertes, Katrina Waters, Bobbie-Jo Webb-Robertson, Antony Williams, David Wishart
Publication date
2023/11/19
Journal
arXiv preprint arXiv:2311.11437
Description
On August 9-10, 2023, a workshop was convened at the Pacific Northwest National Laboratory (PNNL) in Richland, WA that brought together a group of internationally recognized experts in metabolomics, natural products discovery, chemical ecology, chemical and biological threat assessment, cheminformatics, computational chemistry, cloud computing, artificial intelligence, and novel technology development. These experts were invited to assess the value and feasibility of a grand-scale project to create new technologies that would allow the identification and quantification of all small molecules, or to decode the molecular universe. The Decoding the Molecular Universe project would extend and complement the success of the Human Genome Project by developing new capabilities and technologies to measure small molecules (defined as non-protein, non-polymer molecules less than 1500 Daltons) of any origin and generated in biological systems or produced abiotically. Workshop attendees 1) explored what new understanding of biological and environmental systems could be revealed through the lens of small molecules; 2) characterized the similarities in current needs and technical challenges between each science or mission area for unambiguous and comprehensive determination of the composition and quantities of small molecules of any sample; 3) determined the extent to which technologies or methods currently exist for unambiguously and comprehensively determining the small molecule composition of any sample and in a reasonable time; and 4) identified the attributes of the ideal technology or approach for universal small …
Scholar articles
TO Metz, JN Adkins, PB Armentrout, P Chain, F Chu… - arXiv preprint arXiv:2311.11437, 2023