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Agriculture and Food Chemistry

Working Paper

How to Analyse Chemical Compounds? A Guide to Compositional Data Analysis Demonstrated with Beer Data

Matthias Templ, Barbara Templ

Version 1 posted 27 June 2019

712

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Materials Science

Working Paper

Three-Dimensional Chemical Mapping of OTFT on Modified Hydrophobic Flexible Polymeric Substrate by Low Energy Cs+ Ion Sputtering

Luca Tortora, Marco Urbini, Mario Barra, Antonio Cassinese, Paolo Branchini, Alberto Aloisio, Fabio Chiarella, Luigi Mariucci, Matteo Rapisarda, Andrea Fabbri, Francesco Di Capua

Version 1 posted 24 April 2018

617

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Biological and Medicinal Chemistry

Working Paper

Detection of chemometric-guided biomarkers associated with alcohol consumption in mice liver tissue using infrared spectroscopy

Arwa Dahham Qadawee, Ali Forat Algburi, Şebnem Garip Ustaoğlu, İlknur Dursun, Hakan Kaygusuz

Version 1 posted 29 January 2024

125

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Analytical Chemistry

Working Paper

Uncovering the Impact of Spectroscopic Data Reduction Techniques on the Process Control Mode Pattern Recognition: The Case of Industrial Penicillin Production

vishakha vishakha, Josef Jancar

Version 1 posted 09 February 2024

119

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Theoretical and Computational Chemistry

Working Paper

Low Dimensional Representations along Intrinsic Reaction Coordinates and Molecular Dynamics Trajectories Using Interatomic Distance Matrices

Stephanie Hare, Lars Bratholm, David Glowacki, Barry Carpenter

Version 2 posted 05 June 2019

874

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1

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Theoretical and Computational Chemistry

Working Paper

Analysis of the Bath Motion in the MM-SQC Dynamics Using Unsupervised Machine Learning Dimensionality Reduction Approaches: Principal Component Analysis

Jiawei Peng, Yu Xie, Deping Hu, Zhenggang Lan

Version 1 posted 07 December 2020

257

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Chemical Education

Working Paper

Principal Component Analysis (PCA) and Statistical Tests Using Factoshiny and R Commander.

Endler Marcel Borges, Matheus Fernandes Filgueiras

Version 1 posted 25 October 2021

1,430

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7 results in PCA in Keywords: PCA

How to Analyse Chemical Compounds? A Guide to Compositional Data Analysis Demonstrated with Beer Data

Three-Dimensional Chemical Mapping of OTFT on Modified Hydrophobic Flexible Polymeric Substrate by Low Energy Cs+ Ion Sputtering

Detection of chemometric-guided biomarkers associated with alcohol consumption in mice liver tissue using infrared spectroscopy

Uncovering the Impact of Spectroscopic Data Reduction Techniques on the Process Control Mode Pattern Recognition: The Case of Industrial Penicillin Production

Low Dimensional Representations along Intrinsic Reaction Coordinates and Molecular Dynamics Trajectories Using Interatomic Distance Matrices

Analysis of the Bath Motion in the MM-SQC Dynamics Using Unsupervised Machine Learning Dimensionality Reduction Approaches: Principal Component Analysis

Principal Component Analysis (PCA) and Statistical Tests Using Factoshiny and R Commander.

7 results in Keywords: PCA