Cheminfo App Store

Building blocks for cheminformatics and beyond

tga-spectrum
monthly downloads: 84
tga-spectrum provides tools to convert output files from thermogravimetric analysis (TGA) into JCAMP-DX, as well as tools to analyze the data (mass loss analysis)
Supported formats
extensionmanufacturerexample
txtTA Instruments
csvPerkin Elmer
txtPerkin Elmer
jcampcheminfo
version 0.14.1last update Thu Apr 08 2021
xrd-analysis
monthly downloads: 79
xrd-analysis can convert output files from powder-xray diffraction into JCAMP-DX format and perform analysis (Scherrer equation, ...) on the diffractograms
Supported formats
extensionmanufacturerexample
brmlBruker
xyPowDLL
version 0.7.0last update Thu Apr 08 2021
isotherm-analysis
Isotherm (CHMO: 0001992 IUPAC)
monthly downloads: 31
isotherm-analysis allows to parse and analyze isotherms. It converts from multiple formats to JCAMP-DX and provides utilities for basic analysis.
Supported formats
extensionmanufacturerexample
csvMicrometrics
txtIGA
txtMicrometrics
xlsBelsorp
csvDVS-Vacuum
version 0.4.2last update Thu Apr 08 2021
baselines
Baseline Correction
monthly downloads: 515
baselines provides a collection of baseline correction methods.
version 1.0.0last update Thu Apr 08 2021