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| 1 | Fast and interpretable classification of small X-ray diffraction datasets using data augmentation and deep neural networks显示文摘X-ray diffraction(XRD)data acquisition and analysis is among the most time-consuming steps in the development cycle of novel thin-film materials.We propose a machine learning-enabled approach to predict crystallographic dimensionality and space group from a limited number of thin-film XRD patterns.We overcome the scarce data problem intrinsic to novel materials development by coupling a supervised machine learning approach with a model-agnostic,physics-informed data augmentation strategy using simulated data from the Inorganic Crystal Structure Database(ICSD)and experimental data.As a test case,115 thin-film metalhalides spanning three dimensionalities and seven space groups are synthesized and classified.After testing various algorithms,we develop and implement an all convolutional neural network,with cross-validated accuracies for dimensionality and space group classification of 93 and 89%,respectively.We propose average class activation maps,computed from a global average pooling layer,to allow high model interpretability by human experimentalists,elucidating the root causes of misclassification.Finally,we systematically evaluate the maximum XRD pattern step size(data acquisition rate)before loss of predictive accuracy occurs,and determine it to be 0.16°2θ,which enables an XRD pattern to be obtained and classified in 5.5 min or less. | Felipe Oviedo Zekun Ren Shijing Sun Charles Settens Zhe Liu Noor Titan Putri Hartono Savitha Ramasamy Brian L.DeCost Siyu I.P.Tian Giuseppe Romano Aaron Gilad Kusne Tonio Buonassisi | 2019 | npj Computational Materials2019，，1： | 15 |
| 2 | ConfDTree: A Statistical Method for Improving Decision Trees显示文摘Decision trees have three main disadvantages: reduced performance when the training set is small; rigid decision criteria; and the fact that a single 'uncharacteristic' attribute might 'derail' the classification process. In this paper we present ConfDTree(Confidence-Based Decision Tree) — a post-processing method that enables decision trees to better classify outlier instances. This method, which can be applied to any decision tree algorithm, uses easy-to-implement statistical methods(confidence intervals and two-proportion tests) in order to identify hard-to-classify instances and to propose alternative routes. The experimental study indicates that the proposed post-processing method consistently and significantly improves the predictive performance of decision trees, particularly for small, imbalanced or multi-class datasets in which an average improvement of 5%~9% in the AUC performance is reported. | Gilad Katz Asaf Shabtai Lior Rokach Nir Ofek | 2014 | Journal of Computer Science & Technology2014，29，3： | 3 |
| 3 | Image and video upscaling from local self-examples显示文摘 | Gilad Freedman Raanan Fattal | 2011 | ACM Transactions on Graphics (TOG)2011，，2： | 2 |
| 4 | Neurological and functional outcome in patients with supratentorical hemorrhages:A prospective study显示文摘 | Lamp Y Gilad R Eshel Y | 1995 | Stroke1995，26，： | 1 |
| 5 | A herpesvirus associated with mass mortality of juvenile and adult koi, a strain of common carp 显示文摘 | Hedrick R P Gilad O Yun S | 2000 | J Aquatic Animal Health2000，12，1： | 1 |
| 6 | Melatonin inhibits expression of the inducible isoform of nitric oxide synthase in murine macrophages:role of inhibition of NF- κB activation 显示文摘 | E Gilad HR Wong B Zingarelli | 1998 | FASEB J1998，12，： | 1 |
| 7 | Peripheral neuropathy in multiple sclerosis: a clinical and electrophysiologic study显示文摘 | Pinhas IS Achiron A Gilad R | 1995 | Acta Neurol Scand1995，91，： | 1 |
| 8 | Initial characteristics of Koi herpes virus and development of a polymerase chain reaction assay to detect the virus in Koi,Cyprinus carpio Koi显示文摘 | Gilad O Yun S Andree K B | 2002 | Dis Aqua Organ2002，48，： | 1 |
| 9 | Atrial natriuretic peptide levels after different types of inferior wall myocardial infarction 显示文摘 | Assali A Gilad I Herz I | 1997 | Clin Cardiol1997，20，8： | 1 |
| 10 | Antiepileptic treatment in patients with early post-ischemic stroke seizures: a retrospective study显示文摘 | Gilad R Lampl Y Eschel Y | 2001 | CerebrovascDis2001，12，1： | 1 |
| 11 | Marek's disease virus Meq transforms chicken ceils via the V-Jun transcriptional cascade: A converging transforming pathway for avian oncoviruses显示文摘 | Levy A M Gilad O Xia L | 2005 | PNAS2005，102，14： | 1 |
| 12 | It runs in the family: Meta - regulation and its siblings 显示文摘 | Sharon Gilad | 2010 | Regulation & Governance2010，4，4： | 1 |
| 13 | “All-in-one-plate” E-test and diskdiffusion susceptibility co-testing for multiresistant Acinetobacterbaumannii显示文摘 | Gilad J Giladi M Poch F | 2006 | Eur J Clin Microbiol Infect Dis2006，25，： | 1 |
| 14 | Characteristics of opportunities search of entrepreneurs versus executives:Sources,interest,and general alertness显示文摘 | GILAD B | 1991 | Journal of Business Venturing1991，6，1： | 1 |
| 15 | Perpheral neuropathy in multiple sclerosis:a clinical and electrophysiologic study显示文摘 | Sarova PI Achiron A Gilad R | 1995 | Acta Neurol Scand1995，91，4： | 1 |
| 16 | ATM-mediated phospho- rylation of polynucleotide kinase/phosphatase is required for ef- fective DNA double-strand break repair 显示文摘 | Hava SR Gilad M Keren BB | 2011 | EMBO reports2011，96，12： | 1 |
| 17 | Serum microRNAs are promising novel biomar- kers显示文摘 | Gilad S Meiri E Yogev Y | 2008 | PLoS 0ne2008，3，9： | 1 |
| 18 | A study of vertbra and disc geometric relations of the human cervical and lumbar spine 显示文摘 | Gilad I Nissan M | 1986 | Spine (S0362-2436)1986，11，2： | 1 |
| 19 | A single Ataxia Telangiectasia gene with a product similar to PI - 3 kinase 显示文摘 | Savitsky A Bar shira A Gilad S | 1995 | Science1995，268，： | 1 |
| 20 | Trimodal gadolinium-gold microcapsules containing pancreatic islet cells restore normoglyce-mia in diabetic mice and can be tracked by using US,CT,and positive-contrast MR imaging显示文摘 | Arifin DR Long CM Gilad AA | | 0，，： | 1 |
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