Papers citing Nanoinformatics, and the big challenges for the science of small things
Predicting structure/property relationships in multi-dimensional nanoparticle data using t-distributed stochastic neighbour embedding and machine learning
Nanoscale · 2019
Amanda Susan Barnard, George Opletal
Read original paper ↗ ·Ab Initio Simulations and Materials Chemistry in the Age of Big Data
Journal of Chemical Information and Modeling · 2019
Gabriel Ravanhani Schleder, A. C. M. Padilha, Alexandre Reily Rocha, Gustavo M. Dalpian, A. Fazzio
Read original paper ↗ ·Feature Engineering of Solid‐State Crystalline Lattices for Machine Learning
Advanced Theory and Simulations · 2019
Timothy O. Cox, Benyamin Motevalli, George Opletal, Amanda Susan Barnard
Read original paper ↗ ·Machine learning reveals multiple classes of diamond nanoparticles
Nanoscale Horizons · 2020
Amanda J. Parker, Amanda Susan Barnard
Read original paper ↗ ·The Emerging Role of Nano-informatics in America
SSRN Electronic Journal · 2020
Rahul Reddy Nadikattu
Read original paper ↗ ·Machine learning at the (sub)atomic scale: next generation scanning probe microscopy
Machine Learning Science and Technology · 2020
Oliver Gordon, Philip Moriarty
Read original paper ↗ ·Shaping the Future of Solid‐State Electrolytes through Computational Modeling
Advanced Materials · 2020
Ardeshir Baktash, James C. Reid, Qinghong Yuan, Tanglaw Roman, Debra J. Searles
Read original paper ↗ ·Understanding and Predicting the Cause of Defects in Graphene Oxide Nanostructures Using Machine Learning
The Journal of Physical Chemistry C · 2020
Benyamin Motevalli, Baichuan Sun, Amanda Susan Barnard
Read original paper ↗ ·Nanomaterial Transformation in the Soil–Plant System: Implications for Food Safety and Application in Agriculture
Small · 2020
Peng Zhang, Zhiling Guo, Zhiyong Zhang, Hualing Fu, Jason Christopher White, Iseult Lynch
Read original paper ↗ ·Accurate prediction of binding energies for two‐dimensional catalytic materials using machine learning
ChemCatChem · 2020
Julia Melisande Theresa Agatha Fischer, Michelle A. Hunter, Marlies Hankel, Debra J. Searles, Amanda J. Parker, Amanda Susan Barnard
Read original paper ↗ ·Selecting machine learning models for metallic nanoparticles
Nano Futures · 2020
Amanda Susan Barnard, George Opletal
Read original paper ↗ ·Role of Artificial Intelligence and Machine Learning in Nanosafety
Small · 2020
David Alan Winkler
Read original paper ↗ ·Best Practice Leads to the Best Materials Informatics
Matter · 2020
Amanda Susan Barnard
Read original paper ↗ ·Classification of platinum nanoparticle catalysts using machine learning
Journal of Applied Physics · 2020
Amanda J. Parker, George Opletal, Amanda Susan Barnard
Read original paper ↗ ·Exchange Spin Coupling from Gaussian Process Regression
The Journal of Physical Chemistry A · 2020
Marc Philipp Bahlke, Natnael Mogos, Jonny Proppe, Carmen Herrmann
Read original paper ↗ ·Effect of the Albumin Corona on the Toxicity of Combined Graphene Oxide and Cadmium to Daphnia magna and Integration of the Datasets into the NanoCommons Knowledge Base
Nanomaterials · 2020
Diego Stéfani T. Martinez, Gabriela Helena da Silva, Aline Maria Zigiotto de Medeiros, Latif Ullah Khan, Anastasios G. Papadiamantis, Iseult Lynch
Read original paper ↗ ·Flow Synthesis of Metal Halide Perovskite Quantum Dots: From Rapid Parameter Space Mapping to AI-Guided Modular Manufacturing
Matter · 2020
Kameel Abdel‐Latif, Fazel Bateni, Steven H. Crouse, Milad Abolhasani
Read original paper ↗ ·A review of the biomechanical properties of single extracellular vesicles
Nano Select · 2020
Michael D. LeClaire, James Kazimierz Gimzewski, Shivani Sharma
Read original paper ↗ ·TÉCNICAS DE MINERAÇÃO DE TEXTO APLICADAS EM ANÁLISE DE PATENTES
Anais ... Congresso Internacional do Conhecimento e Inovação · 2020
Luciano Zamperetti Wolski, L Artese, Alexandre Gonçalves, Rafael Mattos
Read original paper ↗ ·The pure and representative types of disordered platinum nanoparticles from machine learning
Nanotechnology · 2020
Amanda J. Parker, Benyamin Motevalli, George Opletal, Amanda Susan Barnard
Read original paper ↗ ·Advanced Technologies in Health and Neurodegenerative Diseases
Springer eBooks · 2021
Nikolaos Naziris, Costas Demetzos
Read original paper ↗ ·Charge-Dependent Fermi Level of Graphene Oxide Nanoflakes from Machine Learning
Computational Materials Science · 2021
Benyamin Motevalli, Bronwyn Louise Fox, Amanda Susan Barnard
Read original paper ↗ ·Impact of atomistic or crystallographic descriptors for classification of gold nanoparticles
Nanoscale · 2021
Haonan Zhang, Amanda Susan Barnard
Read original paper ↗ ·Unsupervised structure classes vs. supervised property classes of silicon quantum dots using neural networks
Nanoscale Horizons · 2021
Amanda J. Parker, Amanda Susan Barnard
Read original paper ↗ ·Coloring Molecules with Explainable Artificial Intelligence for Preclinical Relevance Assessment
Journal of Chemical Information and Modeling · 2021
José Jiménez-Luna, Miha Škalič, Nils Weskamp, Gisbert Schneider
Read original paper ↗ ·Fast derivation of Shapley based feature importances through feature extraction methods for nanoinformatics
Machine Learning Science and Technology · 2021
Tommy Liu, Amanda Susan Barnard
Read original paper ↗ ·Enhancing classical gold nanoparticle simulations with electronic corrections and machine learning
Journal of Physics Condensed Matter · 2021
Ryan Stocks, Amanda Susan Barnard
Read original paper ↗ ·The data-intensive scientific revolution occurring where two-dimensional materials meet machine learning
Cell Reports Physical Science · 2021
Hang Yin, Zhehao Sun, Zhuo Wang, Dawei Tang, Cheng Heng Pang, Xue‐Feng Yu, Amanda Susan Barnard, Haitao Zhao, Zongyou Yin
Read original paper ↗ ·Interfacial informatics
Journal of Physics Materials · 2021
Julia Melisande Theresa Agatha Fischer, Amanda J Parker, Amanda Susan Barnard
Read original paper ↗ ·Machine-Learned Decision Trees for Predicting Gold Nanorod Sizes from Spectra
The Journal of Physical Chemistry C · 2021
Katsuya Shiratori, Logan D. C. Bishop, Behnaz Ostovar, Rashad Baiyasi, Yiyu Cai, Peter J. Rossky, Christy F. Landes, Stephan Link
Read original paper ↗ ·Identifying diverse metal oxide nanomaterials with lethal effects on embryonic zebrafish using machine learning
Beilstein Journal of Nanotechnology · 2021
Richard Marchese Robinson, Haralambos Sarimveis, Philip Doganis, Xiaodong Jia, Marianna I. Kotzabasaki, Christiana Gousiadou, Stacey L. Harper, Terry Wilkins
Read original paper ↗ ·Inverse Design of Nanoparticles Using Multi‐Target Machine Learning
Advanced Theory and Simulations · 2021
Sichao Li, Amanda Susan Barnard
Read original paper ↗ ·Nanomaterial transformation in root–soil interface: a function of root exudate or microbial activity?
Elsevier eBooks · 2022
Peng Zhang, Wanqin Dai, Chaonan Dong, Zhiyong Zhang
Read original paper ↗ ·Optimization-Free Inverse Design of High-Dimensional Nanoparticle Electrocatalysts Using Multi-target Machine Learning
Lecture notes in computer science · 2022
Sichao Li, Jonathan Y. C. Ting, Amanda Susan Barnard
Read original paper ↗ ·Daphnia magna and mixture toxicity with nanomaterials – Current status and perspectives in data-driven risk prediction
Nano Today · 2022
Diego Stéfani T. Martinez, Laura‐Jayne A. Ellis, Gabriela Helena da Silva, Romana Petry, Aline Maria Zigiotto de Medeiros, Hossein Hayat Davoudi, Anastasios G. Papadiamantis, A. Fazzio, Antreas Afantitis, Georgia Melagraki, Iseult Lynch
Read original paper ↗ ·Predicting the Probability of Observation of Arbitrary Graphene Oxide Nanoflakes Using Artificial Neural Networks
Advanced Theory and Simulations · 2022
Benyamin Motevalli, Lachlan Hyde, Bronwyn Louise Fox, Amanda Susan Barnard
Read original paper ↗ ·Text Mining for Energy Materials
Journal of Research in Science and Engineering · 2022
Read original paper ↗ ·Data-driven causal inference of process-structure relationships in nanocatalysis
Current Opinion in Chemical Engineering · 2022
Jonathan Y. C. Ting, Amanda Susan Barnard
Read original paper ↗ ·Safety-by-design using forward and inverse multi-target machine learning
Chemosphere · 2022
Sichao Li, Amanda Susan Barnard
Read original paper ↗ ·Where Is Nano Today and Where Is It Headed? A Review of Nanomedicine and the Dilemma of Nanotoxicology
ACS Nano · 2022
Cátia Domingues, Ana Cláudia Paiva‐Santos, Carmen Alvarez‐Lorenzo, Ángel Concheiro, Ivana Jarak, Francisco Veiga, I.R. Barbosa, Marı́lia Dourado, Ana Figueiras
Read original paper ↗ ·Causal Paths Allowing Simultaneous Control of Multiple Nanoparticle Properties Using Multi‐Target Bayesian Inference
Advanced Theory and Simulations · 2022
Jonathan Y. C. Ting, Sichao Li, Amanda Susan Barnard
Read original paper ↗ ·Threats to Terrestrial Plants from Emerging Nanoplastics
ACS Nano · 2022
Fei Dang, Qingyu Wang, Xiliang Yan, Yuanye Zhang, Jiachen Yan, Huan Zhong, Dongmei Zhou, Yongming Luo, Yong‐Guan Zhu, Baoshan Xing, Yujun Wang
Read original paper ↗ ·Physiologically Based Pharmacokinetic Modeling of Nanoparticle Biodistribution: A Review of Existing Models, Simulation Software, and Data Analysis Tools
International Journal of Molecular Sciences · 2022
Elena O. Kutumova, Ilya R. Akberdin, Ilya N. Kiselev, Ruslan Sharipov, Vera S. Egorova, Anastasiia O. Syrocheva, Alessandro Parodi, Andrey A. Zamyatnin, Fedor Kolpakov
Read original paper ↗ ·The impact of domain-driven and data-driven feature selection on the inverse design of nanoparticle catalysts
Journal of Computational Science · 2022
Sichao Li, Jonathan Y. C. Ting, Amanda Susan Barnard
Read original paper ↗ ·Using Machine Learning to make nanomaterials sustainable
The Science of The Total Environment · 2022
Janeck James Scott-Fordsmand, Mónica J.B. Amorim
Read original paper ↗ ·Federated data processing and learning for collaboration in the physical sciences
Machine Learning Science and Technology · 2022
Wenjiang Huang, Amanda Susan Barnard
Read original paper ↗ ·Prediction and Construction of Energetic Materials Based on Machine Learning Methods
Molecules · 2022
Xiaowei Zang, Xiang Zhou, Haitao Bian, Weiping Jin, Xuhai Pan, Juncheng Jiang, M. Yu. Koroleva, Ruiqi Shen
Read original paper ↗ ·Advanced Technologies in Health and Neurodegenerative Diseases
Springer eBooks · 2023
Nikolaos Naziris, Costas Demetzos
Read original paper ↗ ·An Investigation on the Impacts of Calcium Oxide Nanoparticles Enriched Feed in the Survival, Bioaccumulation and Physiological Phenomenon in Zebra Fish (Danio Rerio)
SSRN Electronic Journal · 2023
Madhubala Kumari, Aastha Tiwary, Biplab Sarkar, Koel Mukherjee
Read original paper ↗ ·Data-Driven Design of Classes of Ruthenium Nanoparticles Using Multitarget Bayesian Inference
Chemistry of Materials · 2023
Jonathan Y. C. Ting, Amanda J. Parker, Amanda Susan Barnard
Read original paper ↗ ·