Chemo (Spain)

Recent papers from Chemo (Spain)

1. Optimizing Nanofiltration Membrane Layer-by-Layer Modification: Chemometric and Morphological InsightsACS Applied Polymer Materials · 2025
2. Multiscale and Multimodal Image Fusion. Coping with Differences in Scanned Area and Spatial Resolution for Raman/Fluorescence Images of Labeled CellsAnalytical Chemistry · 2025
3. Large Language Models (such as ChatGPT) as Tools for Machine Learning-Based Data Insights in Analytical ChemistryAnalytical Chemistry · 2025
4. Influence of differential source patterns in the detection of signals of disproportionate reporting for PARP inhibitorsFrontiers in Drug Safety and Regulation · 2024
5. Probing the Intramolecular Folding of Nucleic Acids with Native Ion Mobility Mass Spectrometry: Strategies and CaveatsAnalytical Chemistry · 2024
6. The MCR‐ALS Trilinearity Constraint for Data With Missing ValuesJournal of Chemometrics · 2024
7. Validation of an In Vitro Diagnostic Test for Endometriosis: Impact of Confounding Medical Conditions and Lesion LocationInternational Journal of Molecular Sciences · 2024
8. Solving the missing value problem in PCA by Orthogonalized-Alternating Least Squares (O-ALS)Chemometrics and Intelligent Laboratory Systems · 2024
9. On the factor ambiguity of MCR problems for blockwise incomplete data setsChemometrics and Intelligent Laboratory Systems · 2024
10. Validation of an in vitro diagnostic test for endometriosis: impact of confounding medical conditions and lesion location2024
11. Blind instrument response function identification from fluorescence decaysBiophysical Reports · 2024
12. Evaluation of QSAR models for predicting mutagenicity: outcome of the Second Ames/QSAR international challenge projectSAR and QSAR in environmental research · 2023
13. In silico approaches in carcinogenicity hazard assessment: case study of pregabalin, a nongenotoxic mouse carcinogenFrontiers in Toxicology · 2023
14. ELIXIR and Toxicology: a community in developmentF1000Research · 2023
15. Development and Validation of an Endometriosis Diagnostic Method Based on Serum Biomarkers and Clinical VariablesBiomolecules · 2023
16. Kernelizing: A way to increase accuracy in trilinear decomposition analysis of multiexponential signalsAnalytica Chimica Acta · 2023
17. Study of the photobleaching phenomenon to optimize acquisition of 3D and 4D fluorescence images. A special scenario for trilinear and quadrilinear modelsMicrochemical Journal · 2023
18. Decreased levels of discomfort in repeatedly handled mice during experimental procedures, assessed by facial expressionsFrontiers in Behavioral Neuroscience · 2023
19. Fragment-based virtual screening identifies a first-in-class preclinical drug candidate for Huntington’s diseaseScientific Reports · 2022
20. The trilinear constraint adapted to solve data with strong patterns of outlying observations or missing valuesChemometrics and Intelligent Laboratory Systems · 2022