NOTICE: Due to a lapse in annual appropriations, most of this website is not being updated. Learn more.
Form submissions will still be accepted but will not receive responses at this time. Sections of this site for programs using non-appropriated funds (such as NVLAP) or those that are excepted from the shutdown (such as CHIPS and NVD) will continue to be updated.
An official website of the United States government
Here’s how you know
Official websites use .gov
A .gov website belongs to an official government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you’ve safely connected to the .gov website. Share sensitive information only on official, secure websites.
Similarity Measures of Mass Spectra in Hilbert Spaces
Published
Author(s)
Anthony J. Kearsley, Matthew Roberts
Abstract
Mass spectrometry (MS) is an analytic tool for measuring mass-to-charge ratios of molecules or molecular fragments. It is often used to identify and classify compounds. A mass spectrometer measures the mass of molecules and produces a signal proportional to the number detected fragments, thus, intensity can be interpreted as a function of mass-to-charge. One objective in mass spectrometry is distinguishing compounds using their measured mass spectra. In this technical report we describe the mathematical machinery required to compute a new similarity measure posed in a Hilbert space.
Kearsley, A.
and Roberts, M.
(2024),
Similarity Measures of Mass Spectra in Hilbert Spaces, Technical Note (NIST TN), National Institute of Standards and Technology, Gaithersburg, MD, [online], https://doi.org/10.6028/NIST.TN.2297, https://tsapps.nist.gov/publication/get_pdf.cfm?pub_id=957678
(Accessed October 10, 2025)