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110 results found

Database Infrastructure for Mass Spectrometry - Per- and Polyfluoroalkyl Substances

Data provided by  National Institute of Standards and Technology

Data here contain and describe an open-source structured query language (SQLite) portable database containing high resolution mass spectrometry data (MS1 and MS2) for per- and polyfluorinated alykl substances (PFAS) and associated metadata regarding their measurement techniques, quality assurance metrics, and the samples from which they were produced. These data are stored in a format adhering to the Database Infrastructure for Mass Spectrometry (DIMSpec) project. That project produces and uses databases like this one, providing a complete toolkit for non-targeted analysis.

Tags: per- and polyfluoroalkyl substances,PFAS,database,mass spectrometry,SQLite,emerging contaminants,high resolution mass spectrometry,non-targeted analysis,NTA,HRMS,

Modified: 2024-02-22

Views: 0

NIST DART-MS Forensics Database (is-CID)

Data provided by  National Institute of Standards and Technology

The NIST DART-MS Forensics Database is an evaluated collection of in-source collisionally-induced dissociation (is-CID) mass spectra of compounds of interest to the forensics community (e.g. seized drugs, cutting agents, etc.). The is-CID mass spectra were collected using Direct Analysis in Real-Time (DART) Mass Spectrometry (MS), either by NIST scientists or by contributing agencies noted per compound. The database is provided as a general-purpose structure data file (.SDF).

Tags: Standard reference data,mass spectra,Ion Fragmentation,mass spectrometry,NIST Mass Spectral Libraries,Chemical Identification,Biosciences and Health,Security and Forensics,

Modified: 2024-02-22

Views: 0

Microplastic and nanoplastic chemical characterization by thermal desorption and pyrolysis mass spectrometry with unsupervised machine learning

Data provided by  National Institute of Standards and Technology

This data publication contains the mass spectrometry chemical characterization of microplastic and nanoplastic chemical analysis. The data from this study includes mass spectra of pure, mixed, and weathered microplastics and nanoplastics at high and low fragmentation, extracted ion chronograms, Kendrick mass defect plots, code, and the derived and processed data. The data analysis code (MATLAB 2022a*) used for unsupervised learning of cluster and compositional relationships is also included.

Tags: Microplastic,Nanoplastics,environment,mass spectrometry,GC-MS,Chemical Characterization,machine learning,

Modified: 2024-02-22

Views: 0

Per- and polyfluoroalkyl substances (PFAS) Interferents List

Data provided by  National Institute of Standards and Technology

A table of known interferences for per- and polyfluoroalkyl substances using mass spectrometry.

Tags: per- and polyfluoroalkyl substances,PFAS,mass spectrometry,analytical chemistry,high-resolution mass spectrometry,HRMS,LC-MS/MS,

Modified: 2024-02-22

Views: 0

Supplemental Data and Source Code for ILSA Research

Data provided by  National Institute of Standards and Technology

Source code associated with the Inverted Library Search Algorithm (ILSA) for identifying mixture components using is-CID mass spectra. This source code is frozen to accompany the manuscript titled "Updates to the Inverted Library Search Algorithm for mixture analysis" by Moorthy et. al.

Tags: mass spectrometry,Mixture Analysis,Search Algorithms,seized drug analysis,

Modified: 2024-02-22

Views: 0

FCpy: Feldman-Cousins Confidence Interval Calculator

Data provided by  National Institute of Standards and Technology

Python scripts and Python+Qt graphical user interface for calculating Feldman-Cousins confidence intervals for low-count Poisson processes in the presence of a known background and for Gaussian processes with a physical lower limit of 0.

Tags: python,SIMS,statistics,mass spectrometry,Confidence Interval,CI,Feldman,Cousins,Poisson,Gaussian,

Modified: 2024-02-22

Views: 0

Almanac API - Parameters

Data provided by  National Telecommunications and Information Administration

Almanac API - Ranking by Geography ID within the Nation

Tags: ARRA,Broadband,Broadband Data Improvement Act,Community Anchor Institutions,FCC,Federal Communications Commission,NSGIC,NTIA,National Broadband Map,National Telecomunications and Information Administration,SBDD,State Broadband Data and Development Program,State Broadband Initiative,gov20,opengov,

Modified: 2024-02-22

Views: 0

Almanac API - Ranking by Geography ID within a State

Data provided by  National Telecommunications and Information Administration

This API is designed to find the rankings by geography within the state for a specific metric (population or household) and rank (any of the metrics from provider, demographic, technology or speed). The results are the top ten and bottom ten records within the state for the particular geography type and my area rankings. Additionally we include +/- 5 rankings from the 'my' area rank.

Tags: ARRA,Broadband,Broadband Data Improvement Act,Community Anchor Institutions,FCC,NSGIC,NTIA,National Broadband Map,State Broadband Data and Development grant Program,State Broadband Initiative,gov20,opengov,

Modified: 2024-02-22

Views: 0

Almanac API - Ranking by Geography ID within the Nation

Data provided by  National Telecommunications and Information Administration

This API is designed to find the rankings by any geography ID within the nation with a specific census metric (population or household) and ranking metric (any of the metrics from provider, demographic, technology or speed). The results are the top ten and bottom ten rankings within the nation for the particular geography type and my area rankings include +/- 5 rankings from the my area rank.

Tags: ARRA,Broadband,Broadband Data Improvement Act,Community Anchor Institutions,FCC,NSGIC,NTIA,National Broadband Map,State Broadband Data and Development grant Program,State Broadband Initiative,gov20,opengov,

Modified: 2024-02-22

Views: 0

Almanac API - Ranking by Geography Type within a State

Data provided by  National Telecommunications and Information Administration

This API is designed to find the rankings by any geography type within the state with a specific census metric (population or household) and ranking metric (any of the metrics from provider, demographic, technology or speed). Only the top ten and bottom ten rankings would be returned through the API if the result set is greater than 500; otherwise full ranking list be returned.

Tags: ARRA,Broadband,Broadband Data Improvement Act,Community Anchor Institutions,FCC,NSGIC,NTIA,National Broadband Map,State Broadband Data and Development grant Program,State Broadband Initiative,gov20,opengov,

Modified: 2024-02-22

Views: 0