AIMC Topic: Adsorption

Clear Filters Showing 1 to 10 of 162 articles

High-Throughput Analysis of Protein Adsorption to a Large Library of Polymers Using Liquid Extraction Surface Analysis-Tandem Mass Spectrometry (LESA-MS/MS).

Analytical chemistry Jun 10, 2025
Biomaterials play an important role in medicine from contact lenses to joint replacements. High-throughput screening coupled with machine learning has identified synthetic polymers that prevent bacterial biofilm formation, prevent fungal cell attachm...
Machine Learning Adsorption Proteins Liquid-Liquid Extraction High-Throughput Screening Assays Surface Properties Polymers Tandem Mass Spectrometry
View on PubMed DOI

Predicting biomolecule adsorption on nanomaterials: a hybrid framework of molecular simulations and machine learning.

Nanoscale May 2, 2025
The adsorption of biomolecules on the surface of nanomaterials (NMs) is a critical determinant of their behavior, toxicity, and efficacy in biological systems. Experimental testing of these phenomena is often costly or complicated. Computational appr...
Adsorption Amino Acids Molecular Dynamics Simulation Machine Learning Nanostructures Quantitative Structure-Activity Relationship Surface Properties
View on PubMed DOI

Electrochemical activation of alum sludge for the adsorption of lead (Pb(II)) and arsenic (As): Mechanistic insights and machine learning (ML) analysis.

Bioresource technology Apr 20, 2025
Alum sludge (AlS) has emerged as an effective adsorbent for anionic contaminants, with traditional activation methods like acid/base treatments and calcination employed to enhance its adsorption capacity. However, these approaches encounter significa...
Adsorption Electrochemical Techniques Sewage Alum Compounds Arsenic Lead Water Pollutants, Chemical Machine Learning Water Purification
View on PubMed DOI

Modeling PFAS Sorption in Soils Using Machine Learning.

Environmental science & technology Apr 11, 2025
In this study, we introduce PFASorptionML, a novel machine learning (ML) tool developed to predict solid-liquid distribution coefficients () for per- and polyfluoroalkyl substances (PFAS) in soils. Leveraging a data set of 1,274 entries for PFAS in ...
Adsorption Soil Pollutants Machine Learning Soil Fluorocarbons
View on PubMed DOI

Biohybrid microrobots with a Spirulina skeleton and MOF skin for efficient organic pollutant adsorption.

Nanoscale Mar 24, 2025
Wastewater treatment is a key component in maintaining environmental health and sustainable urban life, and the rapid development of micro/nanotechnology has opened up new avenues for more efficient treatment processes. This work developed a novel bi...
Metal-Organic Frameworks Spirulina Rhodamines Methylene Blue Azo Compounds Adsorption Robotics Water Purification Water Pollutants, Chemical
View on PubMed DOI

Machine Learning for Quantitative Prediction of Protein Adsorption on Well-Defined Polymer Brush Surfaces with Diverse Chemical Properties.

Langmuir : the ACS journal of surfaces and colloids Mar 12, 2025
Polymer informatics has attracted increasing attention because machine learning can establish quantitative structure-property relationships in polymer materials. Understanding and controlling protein adsorption on polymer surfaces are crucial for var...
Muramidase Surface Properties Serum Albumin, Bovine Cattle Adsorption Machine Learning Polymers Animals
View on PubMed DOI

Development of hybrid robust model based on computational modeling and machine learning for analysis of drug sorption onto porous adsorbents.

Scientific reports Mar 12, 2025
This study investigates the utilization of three regression models, i.e., Kernel Ridge Regression (KRR), nu-Support Vector Regression ([Formula: see text]-SVR), and Polynomial Regression (PR) for the purpose of forecasting the concentration (C) of a ...
Algorithms Computer Simulation Porosity Pharmaceutical Preparations Machine Learning Adsorption
View on PubMed DOI

Comparative immobilization of 30 PFAS mixtures onto biochar, clay, nanoparticle, and polymer derived engineered adsorbents: Machine learning insights into carbon chain length and removal mechanism.

Journal of hazardous materials Feb 25, 2025
Per- and polyfluoroalkyl substances (PFAS) are a group of fluorinated chemicals that cause potential risk in PFAS-impacted soil and water. The adsorption efficiency of 30 PFAS mixtures using different adsorbents in environmentally relevant concentrat...
Fluorocarbons Nanoparticles Clay Water Pollutants, Chemical Charcoal Polymers Machine Learning Adsorption
View on PubMed DOI

Integrated learning framework for enhanced specific surface area, pore size, and pore volume prediction of biochar.

Bioresource technology Feb 21, 2025
Specific surface area, pore size, and pore volume are essential biochar properties. Optimization typically reduces yield by focusing on per gram of biochar. This work introduces new indicators and an integrated model to balance quality and quantity, ...
Charcoal Biomass Machine Learning Surface Properties Porosity Adsorption Temperature
View on PubMed DOI

Selective gas adsorption using graphitic carbon nitride: Exploring the role of molecular descriptors by artificial intelligence frameworks.

Journal of environmental management Feb 10, 2025
Artificial Intelligence (AI) frameworks estimate the adsorption energies of crucial pollutants like CO, O, NO, NO, SOF, HCHO, and CO on Graphitic Carbon Nitride (g-CN) surfaces. The predictive capabilities of two AI-based models, namely, Artificial N...
Nitrogen Compounds Gases Adsorption Neural Networks, Computer Graphite Artificial Intelligence
View on PubMed DOI
Popular Topics
Recent Journals