Seven Golden Rules for heuristic filtering of molecular formulas obtained by accurate mass spectrometry
<p>Abstract</p> <p>Background</p> <p>Structure elucidation of unknown small molecules by mass spectrometry is a challenge despite advances in instrumentation. The first crucial step is to obtain correct elemental compositions. In order to automatically constrain the tho...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
| Published: |
BMC
2007-03-01
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| Series: | BMC Bioinformatics |
| Online Access: | http://www.biomedcentral.com/1471-2105/8/105 |