Machine Learning Methods to Improve Crystallization through the Prediction of Solute–Solvent Interactions
A Kandaswamy, SP Schwaminger - Crystals, 2024 - mdpi.com
Crystallization plays a crucial role in defining the quality and functionality of products across
various industries, including pharmaceutical, food and beverage, and chemical …
various industries, including pharmaceutical, food and beverage, and chemical …
The first report on the assessment of maximum acceptable daily intake (MADI) of pesticides for humans using intelligent consensus predictions
Direct or indirect consumption of pesticides and their related products by humans and other
living organisms without safe dosing may pose a health risk. The risk may arise after a …
living organisms without safe dosing may pose a health risk. The risk may arise after a …
[HTML][HTML] Harnessing a better future: exploring AI and ML applications in renewable energy
TH Nguyen, P Paramasivam, HC Le… - JOIV: International Journal …, 2024 - joiv.org
Integrating machine learning (ML) and artificial intelligence (AI) with renewable energy
sources, including biomass, biofuels, engines, and solar power, can revolutionize the …
sources, including biomass, biofuels, engines, and solar power, can revolutionize the …
[HTML][HTML] Data-driven, explainable machine learning model for predicting volatile organic compounds' standard vaporization enthalpy
The accurate prediction of standard vaporization enthalpy (Δ vap H m°) for volatile organic
compounds (VOCs) is of paramount importance in environmental chemistry, industrial …
compounds (VOCs) is of paramount importance in environmental chemistry, industrial …
[HTML][HTML] Predicting the stereoselectivity of chemical reactions by composite machine learning method
Stereoselective reactions have played a vital role in the emergence of life, evolution, human
biology, and medicine. However, for a long time, most industrial and academic efforts …
biology, and medicine. However, for a long time, most industrial and academic efforts …
[HTML][HTML] Machine Learning in Bio-cheminformatics
In recent years, the application of machine learning (ML), including deep learning (DL), has
experienced exponential growth, which has promoted data-driven discovery in diverse …
experienced exponential growth, which has promoted data-driven discovery in diverse …
Data-Driven Approaches to Predict Dendrimer Cytotoxicity
T Maity, AK Balachandran, LP Krishnamurthy… - ACS …, 2024 - ACS Publications
Dendrimers are employed as functional elements in contrast agents and are proposed as
nontoxic vehicles for drug delivery. Toxicity is a property that is to be evaluated for this novel …
nontoxic vehicles for drug delivery. Toxicity is a property that is to be evaluated for this novel …
[HTML][HTML] Extrapolation validation (EV): a universal validation method for mitigating machine learning extrapolation risk
M Yu, YN Zhou, Q Wang, F Yan - Digital Discovery, 2024 - pubs.rsc.org
Machine learning (ML) can provide decision-making advice for major challenges in science
and engineering, and its rapid development has led to advances in fields like chemistry & …
and engineering, and its rapid development has led to advances in fields like chemistry & …
Harnessing Multidimensional Insights and Advanced Machine Learning for Optimized Energy Efficiency: Revolutionizing Sustainable Systems through Predictive …
N Anand, P Parwekar, V Bali - Educational Administration: Theory and …, 2024 - kuey.net
Abstract Integrating Multidimensional Insights for Enhanced Feature Selection in Energy
Transition Models presents a comprehensive approach to enhancing the energy efficiency …
Transition Models presents a comprehensive approach to enhancing the energy efficiency …
A Universal Validation Method for Mitigating Machine Learning Extrapolation Risk
F Yan, M Yu, YN Zhou, Q Wang - 2023 - researchsquare.com
Abstract Machine Learning (ML) can provide decision-making advice for major challenges in
science and engineering, and its rapid development has led to advances in fields like …
science and engineering, and its rapid development has led to advances in fields like …