scholarly journals Finding the Next Superhard Material through Ensemble Learning

2020 ◽  
Author(s):  
Ziyan Zhang ◽  
Aria Mansouri Tehrani ◽  
Anton Oliynyk ◽  
Blake Day ◽  
Jakoah Brgoch
Keyword(s):  
Machine Learning ◽  
Vickers Hardness ◽  
Superhard Material ◽  
Learning Algorithm ◽  
Supervised Machine Learning ◽  
Data Driven ◽  
Superhard Materials ◽  
Ensemble Machine Learning ◽  
Structure Databases ◽  
Hardness Model

We report an ensemble machine-learning method capable of finding new superhard materials by directly predicting the load-dependent Vickers hardness based only on the chemical composition. A total of 1062 experimentally measured load-dependent Vickers hardness data were extracted from the literature and used to train a supervised machine-learning algorithm utilizing boosting, achieving excellent accuracy (R2 = 0.97). This new model was then tested by synthesizing and measuring the load-dependent hardness of several unreported disilicides as well as analyzing the predicted hardness of several classic superhard materials. The trained ensemble method was then employed to screen for superhard materials by examining more than 66,000 compounds in crystal structure databases, which showed that only 68 known materials surpass the superhard threshold. The hardness model was then combined with our data-driven phase diagram generation tool to expand the limited num1 ber of reported compounds. Eleven ternary borocarbide phase spaces were studied, and more than ten thermodynamically favorable compositions with superhard potential were identified, proving this ensemble model’s ability to find previously unknown superhard materials

scholarly journals Finding the Next Superhard Material through Ensemble Learning

2020 ◽  
Author(s):  
Ziyan Zhang ◽  
Aria Mansouri Tehrani ◽  
Anton Oliynyk ◽  
Blake Day ◽  
Jakoah Brgoch
Keyword(s):  
Machine Learning ◽  
Vickers Hardness ◽  
Superhard Material ◽  
Learning Algorithm ◽  
Supervised Machine Learning ◽  
Data Driven ◽  
Superhard Materials ◽  
Ensemble Machine Learning ◽  
Structure Databases ◽  
Hardness Model

We report an ensemble machine-learning method capable of finding new superhard materials by directly predicting the load-dependent Vickers hardness based only on the chemical composition. A total of 1062 experimentally measured load-dependent Vickers hardness data were extracted from the literature and used to train a supervised machine-learning algorithm utilizing boosting, achieving excellent accuracy (R2 = 0.97). This new model was then tested by synthesizing and measuring the load-dependent hardness of several unreported disilicides as well as analyzing the predicted hardness of several classic superhard materials. The trained ensemble method was then employed to screen for superhard materials by examining more than 66,000 compounds in crystal structure databases, which showed that only 68 known materials surpass the superhard threshold. The hardness model was then combined with our data-driven phase diagram generation tool to expand the limited num1 ber of reported compounds. Eleven ternary borocarbide phase spaces were studied, and more than ten thermodynamically favorable compositions with superhard potential were identified, proving this ensemble model’s ability to find previously unknown superhard materials

scholarly journals Predictive Modelling of Employee Turnover in Indian IT Industry Using Machine Learning Techniques

2019 ◽  
Vol 23 (1) ◽  
pp. 12-21 ◽  
Author(s):  
Shikha N. Khera ◽  
Divya
Keyword(s):  
Machine Learning ◽  
Learning Algorithm ◽  
Confusion Matrix ◽  
Predictive Modelling ◽  
Supervised Machine Learning ◽  
Machine Learning Techniques ◽  
Support Vector ◽  
It Industry ◽  
Knowledge Based ◽  
Employee Attrition

Information technology (IT) industry in India has been facing a systemic issue of high attrition in the past few years, resulting in monetary and knowledge-based loses to the companies. The aim of this research is to develop a model to predict employee attrition and provide the organizations opportunities to address any issue and improve retention. Predictive model was developed based on supervised machine learning algorithm, support vector machine (SVM). Archival employee data (consisting of 22 input features) were collected from Human Resource databases of three IT companies in India, including their employment status (response variable) at the time of collection. Accuracy results from the confusion matrix for the SVM model showed that the model has an accuracy of 85 per cent. Also, results show that the model performs better in predicting who will leave the firm as compared to predicting who will not leave the company.

scholarly journals Identification of abnormal tribological regimes using a microphone and semi-supervised machine-learning algorithm

Friction ◽  
2021 ◽  
Author(s):  
Vigneashwara Pandiyan ◽  
Josef Prost ◽  
Georg Vorlaufer ◽  
Markus Varga ◽  
Kilian Wasmer
Keyword(s):  
Machine Learning ◽  
Learning Algorithm ◽  
Industrial Applications ◽  
Supervised Machine Learning ◽  
Normal Operation ◽  
Promising Alternative ◽  
Wear And Tear ◽  
Validation Procedure ◽  
And Performance

AbstractFunctional surfaces in relative contact and motion are prone to wear and tear, resulting in loss of efficiency and performance of the workpieces/machines. Wear occurs in the form of adhesion, abrasion, scuffing, galling, and scoring between contacts. However, the rate of the wear phenomenon depends primarily on the physical properties and the surrounding environment. Monitoring the integrity of surfaces by offline inspections leads to significant wasted machine time. A potential alternate option to offline inspection currently practiced in industries is the analysis of sensors signatures capable of capturing the wear state and correlating it with the wear phenomenon, followed by in situ classification using a state-of-the-art machine learning (ML) algorithm. Though this technique is better than offline inspection, it possesses inherent disadvantages for training the ML models. Ideally, supervised training of ML models requires the datasets considered for the classification to be of equal weightage to avoid biasing. The collection of such a dataset is very cumbersome and expensive in practice, as in real industrial applications, the malfunction period is minimal compared to normal operation. Furthermore, classification models would not classify new wear phenomena from the normal regime if they are unfamiliar. As a promising alternative, in this work, we propose a methodology able to differentiate the abnormal regimes, i.e., wear phenomenon regimes, from the normal regime. This is carried out by familiarizing the ML algorithms only with the distribution of the acoustic emission (AE) signals captured using a microphone related to the normal regime. As a result, the ML algorithms would be able to detect whether some overlaps exist with the learnt distributions when a new, unseen signal arrives. To achieve this goal, a generative convolutional neural network (CNN) architecture based on variational auto encoder (VAE) is built and trained. During the validation procedure of the proposed CNN architectures, we were capable of identifying acoustics signals corresponding to the normal and abnormal wear regime with an accuracy of 97% and 80%. Hence, our approach shows very promising results for in situ and real-time condition monitoring or even wear prediction in tribological applications.

scholarly journals On the Unfounded Enthusiasm for Soft Selective Sweeps III: The Supervised Machine Learning Algorithm That Isn’t

Genes ◽  
2021 ◽  
Vol 12 (4) ◽  
pp. 527
Author(s):  
Eran Elhaik ◽  
Dan Graur
Keyword(s):  
Machine Learning ◽  
Learning Algorithm ◽  
A Priori ◽  
Neutral Theory ◽  
Dominant Mode ◽  
Supervised Machine Learning ◽  
Training Dataset ◽  
Selective Sweeps ◽  
Two Factors ◽  
Negative Controls

In the last 15 years or so, soft selective sweep mechanisms have been catapulted from a curiosity of little evolutionary importance to a ubiquitous mechanism claimed to explain most adaptive evolution and, in some cases, most evolution. This transformation was aided by a series of articles by Daniel Schrider and Andrew Kern. Within this series, a paper entitled “Soft sweeps are the dominant mode of adaptation in the human genome” (Schrider and Kern, Mol. Biol. Evolut. 2017, 34(8), 1863–1877) attracted a great deal of attention, in particular in conjunction with another paper (Kern and Hahn, Mol. Biol. Evolut. 2018, 35(6), 1366–1371), for purporting to discredit the Neutral Theory of Molecular Evolution (Kimura 1968). Here, we address an alleged novelty in Schrider and Kern’s paper, i.e., the claim that their study involved an artificial intelligence technique called supervised machine learning (SML). SML is predicated upon the existence of a training dataset in which the correspondence between the input and output is known empirically to be true. Curiously, Schrider and Kern did not possess a training dataset of genomic segments known a priori to have evolved either neutrally or through soft or hard selective sweeps. Thus, their claim of using SML is thoroughly and utterly misleading. In the absence of legitimate training datasets, Schrider and Kern used: (1) simulations that employ many manipulatable variables and (2) a system of data cherry-picking rivaling the worst excesses in the literature. These two factors, in addition to the lack of negative controls and the irreproducibility of their results due to incomplete methodological detail, lead us to conclude that all evolutionary inferences derived from so-called SML algorithms (e.g., S/HIC) should be taken with a huge shovel of salt.

Clinical Score and Machine Learning-Based Model to Predict Diagnosis of Primary Aldosteronism in Arterial Hypertension

Hypertension ◽  
2021 ◽  
Vol 78 (5) ◽  
pp. 1595-1604
Author(s):  
Fabrizio Buffolo ◽  
Jacopo Burrello ◽  
Alessio Burrello ◽  
Daniel Heinrich ◽  
Christian Adolf ◽  
...  
Keyword(s):  
Machine Learning ◽  
Arterial Hypertension ◽  
Primary Aldosteronism ◽  
Learning Algorithm ◽  
Area Under The Curve ◽  
Clinical Score ◽  
Machine Learning Algorithms ◽  
Supervised Machine Learning ◽  
Individual Risk ◽  
The Individual

Primary aldosteronism (PA) is the cause of arterial hypertension in 4% to 6% of patients, and 30% of patients with PA are affected by unilateral and surgically curable forms. Current guidelines recommend screening for PA ≈50% of patients with hypertension on the basis of individual factors, while some experts suggest screening all patients with hypertension. To define the risk of PA and tailor the diagnostic workup to the individual risk of each patient, we developed a conventional scoring system and supervised machine learning algorithms using a retrospective cohort of 4059 patients with hypertension. On the basis of 6 widely available parameters, we developed a numerical score and 308 machine learning-based models, selecting the one with the highest diagnostic performance. After validation, we obtained high predictive performance with our score (optimized sensitivity of 90.7% for PA and 92.3% for unilateral PA [UPA]). The machine learning-based model provided the highest performance, with an area under the curve of 0.834 for PA and 0.905 for diagnosis of UPA, with optimized sensitivity of 96.6% for PA, and 100.0% for UPA, at validation. The application of the predicting tools allowed the identification of a subgroup of patients with very low risk of PA (0.6% for both models) and null probability of having UPA. In conclusion, this score and the machine learning algorithm can accurately predict the individual pretest probability of PA in patients with hypertension and circumvent screening in up to 32.7% of patients using a machine learning-based model, without omitting patients with surgically curable UPA.

scholarly journals Machine Learning Based Track Classification and Estimation using Kalman Filter

2020 ◽  
Vol 9 (1) ◽  
pp. 1700-1704
Keyword(s):  
Machine Learning ◽  
Kalman Filter ◽  
Learning Algorithm ◽  
Signal To Noise Ratio ◽  
Minimum Mean Square Error ◽  
Velocity Model ◽  
Supervised Machine Learning ◽  
Multiple Target ◽  
Low Snr

Classification of target from a mixture of multiple target information is quite challenging. In This paper we have used supervised Machine learning algorithm namely Linear Regression to classify the received data which is a mixture of target-return with the noise and clutter. Target state is estimated from the classified data using Kalman filter. Linear Kalman filter with constant velocity model is used in this paper. Minimum Mean Square Error (MMSE) analysis is used to measure the performance of the estimated track at various Signal to Noise Ratio (SNR) levels. The results state that the error is high for Low SNR, for High SNR the error is Low

scholarly journals Classifying relevant video tutorials for the school’s learning management system using support vector machine algorithm

2020 ◽  
Author(s):  
Castro Mayleen Dorcas Bondoc ◽  
Tumibay Gilbert Malawit
Keyword(s):  
Machine Learning ◽  
Support Vector Machine ◽  
Learning Process ◽  
Learning Algorithm ◽  
Research Work ◽  
Supervised Machine Learning ◽  
Support Vector ◽  
Video Tutorials ◽  
Learning Management ◽  
Face To Face Instruction

Today many schools, universities and institutions recognize the necessity and importance of using Learning Management Systems (LMS) as part of their educational services. This research work has applied LMS in the teaching and learning process of Bulacan State University (BulSU) Graduate School (GS) Program that enhances the face-to-face instruction with online components. The researchers uses an LMS that provides educators a platform that can motivate and engage students to new educational environment through manage online classes. The LMS allows educators to distribute information, manage learning materials, assignments, quizzes, and communications. Aside from the basic functions of the LMS, the researchers uses Machine Learning (ML) Algorithms applying Support Vector Machine (SVM) that will classify and identify the best related videos per topic. SVM is a supervised machine learning algorithm that analyzes data for classification and regression analysis by Maity [1]. The results of this study showed that integration of video tutorials in LMS can significantly contribute knowledge and skills in the learning process of the students.

scholarly journals Data-Driven Machine-Learning Model in District Heating System for Heat Load Prediction: A Comparison Study

2016 ◽  
Vol 2016 ◽  
pp. 1-11 ◽  
Author(s):  
Fisnik Dalipi ◽  
Sule Yildirim Yayilgan ◽  
Alemayehu Gebremedhin
Keyword(s):  
Machine Learning ◽  
Heat Load ◽  
District Heating ◽  
Heating System ◽  
Partial Least Square ◽  
Supervised Machine Learning ◽  
Data Driven ◽  
Support Vector ◽  
Load Prediction ◽  
District Heating System

We present our data-driven supervised machine-learning (ML) model to predict heat load for buildings in a district heating system (DHS). Even though ML has been used as an approach to heat load prediction in literature, it is hard to select an approach that will qualify as a solution for our case as existing solutions are quite problem specific. For that reason, we compared and evaluated three ML algorithms within a framework on operational data from a DH system in order to generate the required prediction model. The algorithms examined are Support Vector Regression (SVR), Partial Least Square (PLS), and random forest (RF). We use the data collected from buildings at several locations for a period of 29 weeks. Concerning the accuracy of predicting the heat load, we evaluate the performance of the proposed algorithms using mean absolute error (MAE), mean absolute percentage error (MAPE), and correlation coefficient. In order to determine which algorithm had the best accuracy, we conducted performance comparison among these ML algorithms. The comparison of the algorithms indicates that, for DH heat load prediction, SVR method presented in this paper is the most efficient one out of the three also compared to other methods found in the literature.

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