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Decompose Thermo Gravimetrical Analysis (TGA) curves into simpler logistic curves representing mass-change events with a chemical interpretation. All of the analysis is performed with the TensorFlow library for the creation of a NN-analogous model and optimization.
Perform titration curves of any acid-base pair.
Python code to identify and calculate decomposition of materials using Raman spectroscopy
A Shiny R project to ease the statistical validation of analytical methods
Quantitative analysis of chemicals
Evaluation of potentiometric acid-base titrations by non-linear curve fitting
Mass spectral libraries search tool (MSL-ST), used to enhance organic compounds' identification
Program to read output of a Beckman DU 520 through serial connection
Error Estimation of Four main Approximation Equations with Mathematica
This case serves as an illustration how data science can help analytical chemistry, in-field analysis and ecology. An additional point to be stressed is the reality of the subject case. The best practice for data scientists always consists in facing difficulties present in real cases – data cleaning, preparation, analysis of the data logic, stra…
Supplementary material for the manuscript: Potential source areas for atmospheric lead reaching Ny-Ålesund from 2010 to 2018. Authors: Andrea Bazzano, Stefano Bertinetti, Francisco Ardini, David Cappelletti and Marco Grotti.
Software for the optimization of stability constants from potentiometric titration data.
Isotscope is a IUPAC name aware isotopic pattern calculator.
A shiny app for testing equality of mean and variance in one or groups of normal data.
The scripts uploaded in this repository were developed for the automated processing of fluorescence microscopy images of Nile Red stained microplastics
PoliBrush is a freely distributed, stand-alone software designed for teaching exploratory multivariate analysis in the frame of color RGB and spectral imaging. PoliBrush implements principal component analysis (PCA) as its core method.
An open-source Matlab toolbox for multivariate statistical analysis and data mining
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