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Prediction of molecular energy using Coulomb matrix and Graph Neural Network

Hazra et al. | Feb 01, 2022

Prediction of molecular energy using Coulomb matrix and Graph Neural Network

With molecular energy being an integral element to the study of molecules and molecular interactions, computational methods to determine molecular energy are used for the preservation of time and resources. However, these computational methods have high demand for computer resources, limiting their widespread feasibility. The authors of this study employed machine learning to address this disadvantage, utilizing neural networks trained on different representations of molecules to predict molecular properties without the requirement of computationally-intensive processing. In their findings, the authors determined the Feedforward Neural Network, trained by two separate models, as capable of predicting molecular energy with limited prediction error.

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Assessing machine learning model efficacy for brain tumor MRI classification: a multi-model approach

Dhingra et al. | Mar 14, 2026

Assessing machine learning model efficacy for brain tumor MRI classification: a multi-model approach
Image credit: Dhingra and Dhingra

This manuscript explores the performance of five different machine learning models in classifying brain tumors from a dataset of MRI scans. The authors find that several of the models showed >90% accuracy. Thus, the authors suggest that machine learning models demonstrate potential for effective implementation in clinical settings, including as a diagnostic tool that can be used to complement the expertise of neuroradiologists.

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Comparative life cycle analysis: Solvent recycling and improved dewatering scenarios in PHB plastic production

Chiu et al. | Jun 13, 2025

Comparative life cycle analysis: Solvent recycling and improved dewatering scenarios in PHB plastic production

The authors looked at alternative production processes for PHB plastic in an effort to reduce environmental impact. They found that no alternative process was able to significantly decrease the environmental impact of PHB production, but that optimizing dewatering steps during production could lead to the largest improvement on environmental impact.

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