Electrochemical Sensor to Detect Antibiotics in Milk Based on Machine Learning Algorithms.
Timur A AlievVadim E BelyaevAnastasiya V PomytkinaPavel V NesterovSergey ShityakovRoman V SadovnichiiAlexander S NovikovOlga Yu OrlovaMaria S MasalovichEkaterina V SkorbPublished in: ACS applied materials & interfaces (2023)
The present study is dedicated to the problem of electrochemical analysis of multicomponent mixtures, such as milk. A combination of cyclic voltammetry facilities and machine learning techniques made it possible to create a pattern recognition system for the detection of antibiotic residues in skimmed milk. A multielectrode sensor including copper, nickel, and carbon fiber was fabricated for the collection of electrochemical data. Processes occurring at the electrode surface were discussed and simulated with the help of molecular docking and density functional theory modeling. It was assumed that the antibiotic fingerprint reveals a potential drift of electrodes, owing to complexation with metal ions present in milk. The gradient boosting algorithm showed the best efficiency in training the machine learning model. High accuracy was achieved for the recognition of antibiotics in milk. The elaborated method may be incorporated into existing milking systems at dairy farms for monitoring the residue concentrations of antibiotics.
Keyphrases
- machine learning
- molecular docking
- big data
- density functional theory
- artificial intelligence
- ionic liquid
- gold nanoparticles
- label free
- deep learning
- molecular dynamics simulations
- molecularly imprinted
- carbon nanotubes
- high resolution
- mass spectrometry
- climate change
- solid state
- water soluble
- real time pcr
- sensitive detection