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with physicochemical properties as keyword

Applicability Domains Based on Molecular Graph Contrastive Learning Enable Graph Attention Network Models to Accurately ...

Published in Environmental science & technology

In silico models for predicting physicochemical properties and environmental fate parameters are necessary for the sound management of chemicals. This study employed graph attention network (GAT) algorithms to construct such models on 15 end points. The results showed that the GAT models outperformed the previous state-of-the-art models, and their ...

Natural and modified food hydrocolloids as gluten replacement in baked foods: functional benefits

Open Access Article / Gluten, the protein responsible for the superior viscoelastic properties of refined wheat flour dough over gluten-free cereals, causes celiac disease in people susceptible to gluten-allergy. Moreover, the sustainability of using wheat flour in baked foods is threatened by its high cost, especially in countries that depend on i...

Assessing milk products quality, safety, and influencing factors along the dairy value chain in eastern Democratic Repub...

Open Access Journal / Dairying is one of the new promising economic sectors in eastern Democratic Republic of Congo (DRC), but still not explored enough to ensure consumers' safety. This study aimed to assess the health risks and nutritional profile of milk products along the value chain in South-Kivu and Tanganyika provinces. A total of 288 milk a...

SNAPIG: a model to study nutrient digestion and absorption kinetics in growing pigs based on diet and ingredient propert...

Current feed formulation and evaluation practices rely on static values for the nutritional content of feed ingredients and assume additivity. Hereby the complex interplay among nutrients in the diet and the dynamic digestive processes are ignored. To improve future predictions of diet nutritional value requires acknowledging nutrient digestion kin...

Extracting Structural Information from Physicochemical Property Measurements Using Machine Learning─A New Approach for S...

Non-targeted analysis (NTA) has made critical contributions in the fields of environmental chemistry and environmental health. One critical bottleneck is the lack of available analytical standards for most chemicals in the environment. Our study aims to explore a novel approach that integrates measurements of equilibrium partition ratios between or...

Mathematical Modeling of In Vivo Alpha Particle Generators and Chelator Stability.

Published in Cancer biotherapy & radiopharmaceuticals

Background: Targeted α particle therapy using long-lived in vivo α particle generators is cytotoxic to target tissues. However, the redistribution of released radioactive daughters through the circulation should be considered. A mathematical model was developed to describe the physicochemical kinetics of 212Pb-labeled pharmaceuticals and its radioa...

A review of solar and solar-assisted drying of fresh produce: state of the art, drying kinetics, and product qualities.

Published in Journal of the science of food and agriculture

Global demand exists for high-quality fresh produce. Nevertheless, the quality of fresh produce is severely impacted by its perishability due to its high moisture content. Therefore, fresh produces are preserved using artificial dryers (hot-air dryers, catalytic infrared dryers, etc.) driven by electricity or natural fuels. Nonetheless, the exorbit...