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Machine learning and artificial neural network accelerated computational discoveries in materials science
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Frequency-domain energy transport state-resolved Raman for measuring the thermal conductivity of suspended nm-thick MoSe2
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Phonon energy inversion in graphene during transient thermal transport
inferredcites →https://doi.org/10.1016/j.physleta.2013.09.016openalex-snapshot
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Particle swarm Optimized Density-based Clustering and Classification: Supervised and unsupervised learning approaches
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Surface hopping and fully quantum dynamical wavepacket propagation on multiple coupled adiabatic potential surfaces for proton transfer reactions
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Simplifying decision trees
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UNSUPERVISED MACHINE LEARNING CLUSTERING FOR STRATIFICATION OF CARDIAC RISK IN PATIENTS WITH EXERCISE ECHOCARDIOGRAPHY NEGATIVE FOR ISCHEMIA
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Reinforced Adversarial Neural Computer for de Novo Molecular Design
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GuacaMol: Benchmarking Models for de Novo Molecular Design
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Many-Body Coarse-Grained Interactions Using Gaussian Approximation Potentials
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Machine Learning Classical Interatomic Potentials for Molecular Dynamics from First-Principles Training Data
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Machine Learning Predictions of Molecular Properties: Accurate Many-Body Potentials and Nonlocality in Chemical Space
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Machine Learning for Quantum Mechanical Properties of Atoms in Molecules
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Ab Initio-Based Bond Order Potential to Investigate Low Thermal Conductivity of Stanene Nanostructures
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Inclusion of Machine Learning Kernel Ridge Regression Potential Energy Surfaces in On-the-Fly Nonadiabatic Molecular Dynamics Simulation
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Realistic Atomistic Structure of Amorphous Silicon from Machine-Learning-Driven Molecular Dynamics
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Adversarial Threshold Neural Computer for Molecular de Novo Design
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Generative Model for the Inverse Design of Metasurfaces
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Autonomous Molecular Design: Then and Now
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Graphene Aerogel Based Bolometer for Ultrasensitive Sensing from Ultraviolet to Far-Infrared
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Machine Learning Enabled Prediction of Mechanical Properties of Tungsten Disulfide Monolayer
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SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules
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Machine Learning Methods for Property Prediction in Chemoinformatics:Quo Vadis?
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Thermal conductivity of a two-dimensional phosphorene sheet: a comparative study with graphene
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Lateral and flexural phonon thermal transport in graphene and stanene bilayers
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Machine learning and artificial neural network prediction of interfacial thermal resistance between graphene and hexagonal boron nitride
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Direct quantum dynamics using variational Gaussian wavepackets and Gaussian process regression
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QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials
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Machine learning of molecular electronic properties in chemical compound space
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An overview of multi-task learning
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Machine learning based interatomic potential for amorphous carbon
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Accurate interatomic force fields via machine learning with covariant kernels
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Development of a machine learning potential for graphene
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Data-Driven Learning of Total and Local Energies in Elemental Boron
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Generalized Neural-Network Representation of High-Dimensional Potential-Energy Surfaces
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Machine Learning a General-Purpose Interatomic Potential for Silicon
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Microstructural Materials Design Via Deep Adversarial Learning Methodology
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Physics of Iron at Earth's Core Conditions
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Artificial Intelligence in Biomaterials: A Comprehensive Review
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AI-Powered Prediction of Dental Space Maintainer Needs Using X-Ray Imaging: A CNN-Based Approach for Pediatric Dentistry
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Machine Learning Approaches for FDM-Based 3D Printing: A Literature Review
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Dual Intelligent Prediction of Strength and Energy Absorption Performance of Rubber-Modified Concrete via Machine Learning and Metaheuristic Optimization Algorithms
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Molecular Dynamics and Machine Learning in Catalysts
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Crystal-Site-Based Artificial Neural Networks for Material Classification
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Feature Fusion Deep Learning Model for Defects Prediction in Crystal Structures
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Role of Computational Material Science in Improving the Properties of Piezoelectric Smart Materials: A Review
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Deep Learning Models for Bitcoin Prediction Using Hybrid Approaches with Gradient-Specific Optimization
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SSnet: A Deep Learning Approach for Protein-Ligand Interaction Prediction
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Materials Properties Prediction (MAPP): Empowering the Prediction of Material Properties Solely Based on Chemical Formulas
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Modeling and Forecasting Cases of RSV Using Artificial Neural Networks
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Practical Aspects of the Design and Use of the Artificial Neural Networks in Materials Engineering
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Molecular Modeling in Anion Exchange Membrane Research: A Brief Review of Recent Applications
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A Review of Performance Prediction Based on Machine Learning in Materials Science
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On the Sufficiency of a Single Hidden Layer in Feed-Forward Neural Networks Used for Machine Learning of Materials Properties
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AN APPROACH TOWARD PREDICTION OF SM-CO ALLOY’S MAXIMUM ENERGY PRODUCT USING FEATURE BAGGING TECHNIQUE
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Development of a Mobile Application with Artificial Intelligence for Mexican Sign Language Recognition
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Advancing Material Property Prediction With AI and Deep Learning Technologies
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Analysis and Evaluation of the Impacts of Predictive Analytics on Production System Performances in the Semiconductor Industry.
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Conceptual Foundations for Value-Sensitive Design of Materials AI Systems
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Numerical study of discharge characteristics of atmospheric dielectric barrier discharges by integrating machine learning
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Numerical study on discharge characteristics of atmospheric dielectric barrier discharges by integrating machine learning
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