Author: Marcus Ludwig; Louis-Félix Nothias; Kai Dührkop; Irina Koester; Markus Fleischauer; Martin A. Hoffmann; Daniel Petras; Fernando Vargas; Mustafa Morsy; Lihini Aluwihare; Pieter C. Dorrestein; Sebastian Böcker
Title: ZODIAC: database-independent molecular formula annotation using Gibbs sampling reveals unknown small molecules Document date: 2019_11_16
ID: 03uonbrv_46
Snippet: For the dendroides, NIST1950, and tomato datasets we used 15 ppm maximum mass deviation for SIRIUS; for diatoms and mice stool datasets we used 10 ppm. Isotope patterns were not used to lter molecular formula candidates before computing fragmentation trees......
Document: For the dendroides, NIST1950, and tomato datasets we used 15 ppm maximum mass deviation for SIRIUS; for diatoms and mice stool datasets we used 10 ppm. Isotope patterns were not used to lter molecular formula candidates before computing fragmentation trees.
Search related documents:
Co phrase search for related documents- formula candidate and isotope pattern: 1
- formula candidate and molecular formula candidate: 1, 2, 3, 4
- fragmentation tree and isotope pattern: 1, 2
- fragmentation tree and molecular formula candidate: 1
- fragmentation tree compute and isotope pattern: 1
- isotope pattern and molecular formula candidate: 1
Co phrase search for related documents, hyperlinks ordered by date