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RESEARCH PAPER · Progress in Materials Science · 2022

Toward autonomous laboratories: Convergence of artificial intelligence and experimental automation

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Toward autonomous laboratories: Convergence of artificial intelligence and experimental automationOriginalA scientific machine learning framework to understand flash graphene synthesis24What is missing in autonomous discovery: open challenges for the community44Accelerated Electrosynthesis Development Enabled by High-Throughput Experimentation11Training a robotic arm to estimate the weight of a suspended object6Applications of machine learning in supercritical fluids research47Flexible Laboratory Automation System Based on Distributed Framework: Implementation for Press Process in Polymer Materials Development2Review of Low-cost Self-driving Laboratories: The "Frugal Twin" Concept3Impact of noise on inverse design: the case of NMR spectra matching11Chemical Species Ontology for Data Integration and Knowledge Discovery38Application of Digital Methods in Polymer Science and Engineering28Physics Constrained Multi-objective Bayesian Optimization to Accelerate 3D Printing of Thermoplastics19Machine learning in metal-ion battery research: Advancing material prediction, characterization, and status evaluation49Role of multifidelity data in sequential active learning materials discovery campaigns: case study of electronic bandgap7Recent advancements in laboratory automation technology and their impact on scientific research and laboratory procedures6An interpretable and transferrable vision transformer model for rapid materials spectra classification27AlabOS: a Python-based reconfigurable workflow management framework for autonomous laboratories33De novo molecule design towards biased properties via a deep generative framework and iterative transfer learning8Physics Constrained Multi-Objective Bayesian Optimization to Accelerate 3d Printing of Thermoplastics1Physics-informed machine learning enabled virtual experimentation for 3D printed thermoplastic10Probabilistic Neural Networks (PNNs) for Modeling Aleatoric Uncertainty in Scientific Machine Learning10Review of low-cost self-driving laboratories in chemistry and materials science: the “frugal twin” concept93Robotic Automation System of Polymer Press Process for Materials Lab-Automation4Acceleration of optimizing the dielectric properties of (Ca 0.7 Nd 0.2 ) 1− x (Li 0.5 Nd 0.5 ) x Ti 1− y (Mg 1/3 Nb 2/3 ) y O 3 with the aid of machine learning9Machine Learning to Access and Ensure Safe Drinking Water Supply: A Systematic Review6Transforming research laboratories with connected digital twins19High-throughput automated membrane reactor system: The case of CO2/bicarbonate electroreduction4Cutting Edge High‐Throughput Synthesis and Characterization Techniques in Combinatorial Materials Science19Intelligent Algorithms Enable Photocatalyst Design and Performance Prediction25Spatially resolved lock-in micro-thermography (SR-LIT): A tensor analysis-enhanced method for anisotropic thermal characterization14Exploring solvation structure and transport behavior for rational design of advanced electrolytes for next generation of lithium batteries15Patent Analysis in the Realm of Machine Learning in Manufacturing0Protocol for creating representations of molecular structures using a polymer-specific decoder0Recent progress on surface chemistry I: Assembly and reaction67Synergizing human expertise and AI efficiency with language model for microscopy operation and automated experiment design *27Recent progress on surface chemistry II: Property and characterization58Revolutionizing Research Methodologies: The Emergence of Research 5.0 through AI, Automation, and Blockchain0Computational and Machine Learning Methods for CO 2 Capture Using Metal–Organic Frameworks74From Data to Discovery: Recent Trends of Machine Learning in Metal–Organic Frameworks91Machine learning to assess and support safe drinking water supply: a systematic review22Synthesis Strategies for High Entropy Nanoparticles93Predicting and Accelerating Nanomaterial Synthesis Using Machine Learning Featurization32Accurate and Efficient Structure Elucidation from Routine One-Dimensional NMR Spectra Using Multitask Machine Learning59Automation of polymer pressing by robotic handling with in-process parameter optimization4AI-driven 3D bioprinting for regenerative medicine: From bench to bedside101Machine learning materials properties with accurate predictions, uncertainty estimates, domain guidance, and persistent online accessibility17Accelerating the Discovery of Abiotic Vesicles with AI-Guided Automated Experimentation3From synthesis to properties: expanding the horizons of machine learning in nanomaterials research39RedCat, an automated discovery workflow for aqueous organic electrolytes4SANE: strategic autonomous non-smooth exploration for multiple optima discovery in multi-modal and non-differentiable black-box functions4Thermomechanical Assessment of Sports Facilities and Equipment Using Thermography and Artificial Intelligence0AutoMEX: Streamlining material extrusion with AI agents powered by large language models and knowledge graphs24Artificial Intelligence Meets Laboratory Automation in Discovery and Synthesis of Metal–Organic Frameworks: A Review41Comprehensive Screening of Conditions for Block Copolymer Nanoaggregate Formation via Automated DLS2Fully Automated Deep Learning Enabled Miniature Mass Spectrometry System for Psychoactive Therapeutic Drug Monitoring3Searching for materials for next-generation on-chip interconnects4Data-driven approaches for autonomous experimentation: Insights into modeling and prediction dynamics of metal–organic frameworks synthesis0Reaching new frontiers in nanoelectronics through artificial intelligence4AI-driven new materials development and data standardization4The convergence of AI and synthetic biology: the looming deluge55Machine‐learning‐assisted photonic device development: a multiscale approach from theory to characterization19Design of Tough 3D Printable Elastomers with Human‐in‐the‐Loop Reinforcement Learning1Design of Tough 3D Printable Elastomers with Human‐in‐the‐Loop Reinforcement Learning8Self-driving laboratories with artificial intelligence: An overview of process systems engineering perspective14Machine learning in polymer science: A new lens for physical and chemical exploration35Benchmarking universal machine learning interatomic potentials for rapid analysis of inelastic neutron scattering data*4Engineering crop flower morphology facilitates robotization of cross-pollination and speed breeding35Recent Progress in Autonomous Laboratories for Chemical Synthesis4Advancing Organic Chemistry Using High‐Throughput Experimentation26Advancing Organic Chemistry Using High‐Throughput Experimentation7AI‐Driven Advances in Sustainable Materials for Green Energy: From Innovation to Lifecycle Management31ADVANCED FABRICATION AND CHARACTERIZATION OF SILVER NANOPARTICLES USING AI TECHNIQUES4How Machine Learning Has Driven the Development of Rechargeable Ion Batteries21Automating quantum computing laboratory experiments with an agent-based AI framework18Precision Medicine: The Road to In Vivo Synthetic Therapeutic Agent2Building an affordable self-driving lab: Practical machine learning experiments for physics education using Internet-of-Things1Ensemble Learning for Comprehensive Hardness Prediction of High-Entropy Alloys1Dynamic catalysts and the digital age: Synthetic consequences2Artificial intelligence in the development of structural and functional materials: A transformative frontier and complementary enabler of the rational alloy design framework10Accelerated discovery of multinary chalcogenide quantum dots: combining aqueous chemistry with high-throughput experimentation and machine learning3FastCat: Autonomous Discovery of Multielement Layered Double Hydroxide Alloy Catalysts for Alkaline Oxygen Evolution Reaction3A hybrid method based on particle swarm optimization and machine learning algorithm for predicting droplet diameter in a microfluidic T-junction0A vision for mechanical and chemical engineering in 20500Agentic workflow enables the recovery of critical materials from complex feedstocks via selective precipitation0Artificial intelligence and machine learning for plasmonic and surface-enhanced sensing37Can we automate scientific reasoning in closed-loop experiments using large language models?4Enabling knowledge discovery from data0GEMS: a deterministic finite automaton framework for adaptive laboratory automation0PyMESpec: a Python toolbox for automated modulation excitation spectroscopic data analysis and transient experiments0Microstructural engineering of zinc anodes: Expediting the fabrication and industrial-scale deployment of high-performance batteries4Materials Informatics: Emergence to Autonomous Discovery in the Age of AI15Integrating artificial intelligence with electrochemical science for advanced energy storage9High-fidelity morphology prediction for internal modification by pulsed laser utilizing attention guidance mechanism based on physical priors0Machine Learning as a Catalyst in Advanced Materials Research and Development0The ADePT framework for assessing autonomous laboratory robotics8Machine-Learning-Guided Discovery and Statistical Analysis of Multielemental Reverse Water–Gas Shift Catalysts1Bayesian Optimisation for the Experimental Sciences: A Practical Guide to Data‐Efficient Optimisation of Laboratory Workflows5Denoising diffusion probabilistic model-based tabular data augmentation for improved phase classification of high-entropy alloys2Experimental mechanician for plate lattice metamaterial discovery1Accelerate Flash Removal of PFAS from Soil by Human-Guided Bayesian Optimization and Interpretable Machine Learning12026 Roadmap on compositionally complex and high entropy materials for energy applications5Data-driven approaches for functional ceramics3Biodesign x AI: Interactions in the Algorithmic Wet Lab1From Programming to Crystal Growth: High-Throughput Exploration of 3d–4f Cluster Synthesis Conditions–A Laboratory Experiment for First Year Undergraduates0Rebellious AI can be controlled by submissive AI: an overview of background, identifying major problems, and taxonomizing possible solutions0Convenience AI0Materials by machines: A review on intuition and knowledge-driven learning for rapid discovery and optimization0Self-evolving experimental platform for 3D sand printing2Data-Driven Engineering of Antimicrobial Nanomaterials for Food Safety and Biomedical Systems8Self-Driving Scanning Probe Microscopy: From Acceleration to Discovery and Manipulation3Comparative assessment of dilute alloys and complex concentrated alloys: Design principles, processing, mechanisms, properties, and sustainability0Autonomous laboratories for sustainable nanomaterials discovery0Artificial intelligence for carbon materials in electrochemical energy storage: Methods, applications, and perspectives0A review on the discovery and design of biodegradable alloys accelerated by machine learning0Navigating regulatory fragmentation in the convergence of synthetic biology, artificial intelligence, and automation1Integration of Artificial Intelligence and Microfluidics for Drug Delivery Applications0Investigación científica en la era de la inteligencia artificial0Advanced engineering of inorganic semiconductor nanowires: Materials-by-design for next-generation green energy technologies0The artificial intelligence-empowered electrolyte innovations: emerging polymer electrolyte for rechargeable batteries0

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