scholarly journals Using Machine Learning to Predict Obesity Based on Genome-Wide and Epigenome-Wide Gene–Gene and Gene–Diet Interactions

2022 ◽  
Vol 12 ◽  
Author(s):  
Yu-Chi Lee ◽  
Jacob J. Christensen ◽  
Laurence D. Parnell ◽  
Caren E. Smith ◽  
Jonathan Shao ◽  
...  
Keyword(s):  
Machine Learning ◽  
Prediction Models ◽  
Statistical Significance ◽  
Lifestyle Factors ◽  
Dietary Factors ◽  
Gradient Boosting ◽  
Processed Meat ◽  
Test Set ◽  
Stochastic Gradient Boosting ◽  
Genome Wide

Obesity is associated with many chronic diseases that impair healthy aging and is governed by genetic, epigenetic, and environmental factors and their complex interactions. This study aimed to develop a model that predicts an individual’s risk of obesity by better characterizing these complex relations and interactions focusing on dietary factors. For this purpose, we conducted a combined genome-wide and epigenome-wide scan for body mass index (BMI) and up to three-way interactions among 402,793 single nucleotide polymorphisms (SNPs), 415,202 DNA methylation sites (DMSs), and 397 dietary and lifestyle factors using the generalized multifactor dimensionality reduction (GMDR) method. The training set consisted of 1,573 participants in exam 8 of the Framingham Offspring Study (FOS) cohort. After identifying genetic, epigenetic, and dietary factors that passed statistical significance, we applied machine learning (ML) algorithms to predict participants’ obesity status in the test set, taken as a subset of independent samples (n = 394) from the same cohort. The quality and accuracy of prediction models were evaluated using the area under the receiver operating characteristic curve (ROC-AUC). GMDR identified 213 SNPs, 530 DMSs, and 49 dietary and lifestyle factors as significant predictors of obesity. Comparing several ML algorithms, we found that the stochastic gradient boosting model provided the best prediction accuracy for obesity with an overall accuracy of 70%, with ROC-AUC of 0.72 in test set samples. Top predictors of the best-fit model were 21 SNPs, 230 DMSs in genes such as CPT1A, ABCG1, SLC7A11, RNF145, and SREBF1, and 26 dietary factors, including processed meat, diet soda, French fries, high-fat dairy, artificial sweeteners, alcohol intake, and specific nutrients and food components, such as calcium and flavonols. In conclusion, we developed an integrated approach with ML to predict obesity using omics and dietary data. This extends our knowledge of the drivers of obesity, which can inform precision nutrition strategies for the prevention and treatment of obesity.Clinical Trial Registration: [www.ClinicalTrials.gov], the Framingham Heart Study (FHS), [NCT00005121].

scholarly journals Predicting Type 2 Diabetes Incidence with Genome-wide Gene-gene and Gene-diet Interactions (OR31-08-19)

2019 ◽  
Vol 3 (Supplement_1) ◽  
Author(s):  
Crystal Sorgini ◽  
Jacob Christensen ◽  
Laurence Parnell ◽  
Katherine Tucker ◽  
Jose M Ordovas ◽  
...  
Keyword(s):  
Machine Learning ◽  
Type 2 Diabetes ◽  
Lifestyle Factors ◽  
Dietary Factors ◽  
Stochastic Gradient Boosting ◽  
Genome Wide ◽  
A Genome ◽  
Prevention And Treatment ◽  
Genome Wide Scan

Abstract Objectives To identify genetic and dietary factors, and their interactions that contribute to type 2 diabetes (T2D) and predict an individual's risk to design more precise prevention and treatment strategies. Methods A genome-wide scan for up to three-way interactions between 717,275 single nucleotide polymorphisms (SNPs), and 139 dietary and lifestyle factors was conducted on 1380 participants of the Boston Puerto Rican Health Study using the Generalized Multifactor Dimensionality Reduction (GMDR) method. Based on identified genetic and dietary factors, we then used machine learning (ML) to predict T2D risk, and the accuracy of prediction was assessed using area under the Receiver Operating Characteristic curve (ROC-AUC). Results A genome-wide scan for main effects and up to three-way interactions between SNPs and dietary factors using GMDR identified a set of 818 SNPs and 12 dietary factors that were selected for the prediction of T2D incidence. Comparing several ML algorithms, we found that stochastic gradient boosting provided the best prediction accuracy of T2D incidence with ROC-AUC of 0.93 in the training set, and overall accuracy of 85% based on test set validation. This approach identified that 52 SNPs in 37 genes, three food groups of high sugar content, and age were key predictors of the best-fit model. Conclusions This study illustrates a powerful methodology that can predict incidence of T2D based on gene-gene and gene-environment interactions in combination with machine learning. This genome-wide approach allows identification of those diet and lifestyle factors that interact with genotype and can inform personalized nutrition strategies for the prevention and treatment of T2D. Funding Sources This work was funded by the US Department of Agriculture, under agreement no. 8050-51000-098-00D, and NIH grants P01 AG023394, P50 HL105185, and R01 AG027087.

scholarly journals Improving Sports Outcome Prediction Process Using Integrating Adaptive Weighted Features and Machine Learning Techniques

Processes ◽  
2021 ◽  
Vol 9 (9) ◽  
pp. 1563
Author(s):  
Chi-Jie Lu ◽  
Tian-Shyug Lee ◽  
Chien-Chih Wang ◽  
Wei-Jen Chen
Keyword(s):  
Machine Learning ◽  
Outcome Prediction ◽  
Prediction Models ◽  
Machine Learning Algorithms ◽  
Machine Learning Techniques ◽  
Gradient Boosting ◽  
Adaptive Weighting ◽  
Stochastic Gradient Boosting ◽  
Basketball Game ◽  
Extreme Gradient Boosting

Developing an effective sports performance analysis process is an attractive issue in sports team management. This study proposed an improved sports outcome prediction process by integrating adaptive weighted features and machine learning algorithms for basketball game score prediction. The feature engineering method is used to construct designed features based on game-lag information and adaptive weighting of variables in the proposed prediction process. These designed features are then applied to the five machine learning methods, including classification and regression trees (CART), random forest (RF), stochastic gradient boosting (SGB), eXtreme gradient boosting (XGBoost), and extreme learning machine (ELM) for constructing effective prediction models. The empirical results from National Basketball Association (NBA) data revealed that the proposed sports outcome prediction process could generate a promising prediction result compared to the competing models without adaptive weighting features. Our results also showed that the machine learning models with four game-lags information and adaptive weighting of power could generate better prediction performance.

In silico Prediction of Inhibitory Constant of Thrombin Inhibitors Using Machine Learning

2019 ◽  
Vol 21 (9) ◽  
pp. 662-669 ◽  
Author(s):  
Junnan Zhao ◽  
Lu Zhu ◽  
Weineng Zhou ◽  
Lingfeng Yin ◽  
Yuchen Wang ◽  
...  
Keyword(s):  
Machine Learning ◽  
Prediction Models ◽  
Regression Tree ◽  
Large Data ◽  
Thrombin Inhibitors ◽  
Coagulation Cascade ◽  
Gradient Boosting ◽  
Support Vector ◽  
Data Set ◽  
Descriptor Selection

Background: Thrombin is the central protease of the vertebrate blood coagulation cascade, which is closely related to cardiovascular diseases. The inhibitory constant Ki is the most significant property of thrombin inhibitors. Method: This study was carried out to predict Ki values of thrombin inhibitors based on a large data set by using machine learning methods. Taking advantage of finding non-intuitive regularities on high-dimensional datasets, machine learning can be used to build effective predictive models. A total of 6554 descriptors for each compound were collected and an efficient descriptor selection method was chosen to find the appropriate descriptors. Four different methods including multiple linear regression (MLR), K Nearest Neighbors (KNN), Gradient Boosting Regression Tree (GBRT) and Support Vector Machine (SVM) were implemented to build prediction models with these selected descriptors. Results: The SVM model was the best one among these methods with R2=0.84, MSE=0.55 for the training set and R2=0.83, MSE=0.56 for the test set. Several validation methods such as yrandomization test and applicability domain evaluation, were adopted to assess the robustness and generalization ability of the model. The final model shows excellent stability and predictive ability and can be employed for rapid estimation of the inhibitory constant, which is full of help for designing novel thrombin inhibitors.

scholarly journals Development and validation of a difficult laryngoscopy prediction model using machine learning of neck circumference and thyromental height

2021 ◽  
Vol 21 (1) ◽  
Author(s):  
Jong Ho Kim ◽  
Haewon Kim ◽  
Ji Su Jang ◽  
Sung Mi Hwang ◽  
So Young Lim ◽  
...  
Keyword(s):  
Machine Learning ◽  
Random Forest ◽  
Confidence Interval ◽  
Neck Circumference ◽  
Difficult Laryngoscopy ◽  
Gradient Boosting ◽  
Test Set ◽  
Equal Distribution ◽  
Light Gradient ◽  
Extreme Gradient Boosting

Abstract Background Predicting difficult airway is challengeable in patients with limited airway evaluation. The aim of this study is to develop and validate a model that predicts difficult laryngoscopy by machine learning of neck circumference and thyromental height as predictors that can be used even for patients with limited airway evaluation. Methods Variables for prediction of difficulty laryngoscopy included age, sex, height, weight, body mass index, neck circumference, and thyromental distance. Difficult laryngoscopy was defined as Grade 3 and 4 by the Cormack-Lehane classification. The preanesthesia and anesthesia data of 1677 patients who had undergone general anesthesia at a single center were collected. The data set was randomly stratified into a training set (80%) and a test set (20%), with equal distribution of difficulty laryngoscopy. The training data sets were trained with five algorithms (logistic regression, multilayer perceptron, random forest, extreme gradient boosting, and light gradient boosting machine). The prediction models were validated through a test set. Results The model’s performance using random forest was best (area under receiver operating characteristic curve = 0.79 [95% confidence interval: 0.72–0.86], area under precision-recall curve = 0.32 [95% confidence interval: 0.27–0.37]). Conclusions Machine learning can predict difficult laryngoscopy through a combination of several predictors including neck circumference and thyromental height. The performance of the model can be improved with more data, a new variable and combination of models.

Enhanced prediction of vulnerable Web components using Stochastic Gradient Boosting Trees

2019 ◽  
Vol 15 (2) ◽  
pp. 201-214 ◽  
Author(s):  
Mahmoud Elish
Keyword(s):  
Web Applications ◽  
Prediction Models ◽  
Stochastic Gradient ◽  
Gradient Boosting ◽  
Data Sets ◽  
Content Type ◽  
Stochastic Gradient Boosting ◽  
Security Inspection ◽  
Novel Model ◽  
Efficient Software

Purpose Effective and efficient software security inspection is crucial as the existence of vulnerabilities represents severe risks to software users. The purpose of this paper is to empirically evaluate the potential application of Stochastic Gradient Boosting Trees (SGBT) as a novel model for enhanced prediction of vulnerable Web components compared to common, popular and recent machine learning models. Design/methodology/approach An empirical study was conducted where the SGBT and 16 other prediction models have been trained, optimized and cross validated using vulnerability data sets from multiple versions of two open-source Web applications written in PHP. The prediction performance of these models have been evaluated and compared based on accuracy, precision, recall and F-measure. Findings The results indicate that the SGBT models offer improved prediction over the other 16 models and thus are more effective and reliable in predicting vulnerable Web components. Originality/value This paper proposed a novel application of SGBT for enhanced prediction of vulnerable Web components and showed its effectiveness.

scholarly journals Predicting hospitalization following psychiatric crisis care using machine learning

2020 ◽  
Vol 20 (1) ◽  
Author(s):  
Matthijs Blankers ◽  
Louk F. M. van der Post ◽  
Jack J. M. Dekker
Keyword(s):  
Machine Learning ◽  
Logistic Regression ◽  
Prediction Models ◽  
Learning Algorithms ◽  
Nearest Neighbors ◽  
Machine Learning Algorithms ◽  
Gradient Boosting ◽  
Ensemble Model ◽  
K Nearest Neighbors ◽  
Crisis Care

Abstract Background Accurate prediction models for whether patients on the verge of a psychiatric criseis need hospitalization are lacking and machine learning methods may help improve the accuracy of psychiatric hospitalization prediction models. In this paper we evaluate the accuracy of ten machine learning algorithms, including the generalized linear model (GLM/logistic regression) to predict psychiatric hospitalization in the first 12 months after a psychiatric crisis care contact. We also evaluate an ensemble model to optimize the accuracy and we explore individual predictors of hospitalization. Methods Data from 2084 patients included in the longitudinal Amsterdam Study of Acute Psychiatry with at least one reported psychiatric crisis care contact were included. Target variable for the prediction models was whether the patient was hospitalized in the 12 months following inclusion. The predictive power of 39 variables related to patients’ socio-demographics, clinical characteristics and previous mental health care contacts was evaluated. The accuracy and area under the receiver operating characteristic curve (AUC) of the machine learning algorithms were compared and we also estimated the relative importance of each predictor variable. The best and least performing algorithms were compared with GLM/logistic regression using net reclassification improvement analysis and the five best performing algorithms were combined in an ensemble model using stacking. Results All models performed above chance level. We found Gradient Boosting to be the best performing algorithm (AUC = 0.774) and K-Nearest Neighbors to be the least performing (AUC = 0.702). The performance of GLM/logistic regression (AUC = 0.76) was slightly above average among the tested algorithms. In a Net Reclassification Improvement analysis Gradient Boosting outperformed GLM/logistic regression by 2.9% and K-Nearest Neighbors by 11.3%. GLM/logistic regression outperformed K-Nearest Neighbors by 8.7%. Nine of the top-10 most important predictor variables were related to previous mental health care use. Conclusions Gradient Boosting led to the highest predictive accuracy and AUC while GLM/logistic regression performed average among the tested algorithms. Although statistically significant, the magnitude of the differences between the machine learning algorithms was in most cases modest. The results show that a predictive accuracy similar to the best performing model can be achieved when combining multiple algorithms in an ensemble model.

scholarly journals RegioML: Predicting the regioselectivity of electrophilic aromatic substitution reactions using machine learning

2021 ◽  
Author(s):  
Nicolai Ree ◽  
Andreas H. Göller ◽  
Jan H. Jensen
Keyword(s):  
Machine Learning ◽  
Tight Binding ◽  
Reaction Centers ◽  
Gradient Boosting ◽  
Electrophilic Aromatic Substitution ◽  
Aromatic Substitution ◽  
Substitution Reactions ◽  
Test Set ◽  
Light Gradient ◽  
Out Of Sample

We present RegioML, an atom-based machine learning model for predicting the regioselectivities of electrophilic aromatic substitution reactions. The model relies on CM5 atomic charges computed using semiempirical tight binding (GFN1-xTB) combined with the ensemble decision tree variant light gradient boosting machine (LightGBM). The model is trained and tested on 21,201 bromination reactions with 101K reaction centers, which is split into a training, test, and out-of-sample datasets with 58K, 15K, and 27K reaction centers, respectively. The accuracy is 93% for the test set and 90% for the out-of-sample set, while the precision (the percentage of positive predictions that are correct) is 88% and 80%, respectively. The test-set performance is very similar to the graph-based WLN method developed by Struble et al. (React. Chem. Eng. 2020, 5, 896) though the comparison is complicated by the possibility that some of the test and out-of-sample molecules are used to train WLN. RegioML out-performs our physics-based RegioSQM20 method (J. Cheminform. 2021, 13:10) where the precision is only 75%. Even for the out-of-sample dataset, RegioML slightly outperforms RegioSQM20. The good performance of RegioML and WLN is in large part due to the large datasets available for this type of reaction. However, for reactions where there is little experimental data, physics-based approaches like RegioSQM20 can be used to generate synthetic data for model training. We demonstrate this by showing that the performance of RegioSQM20 can be reproduced by a ML-model trained on RegioSQM20-generated data.

scholarly journals Learning from Imbalanced Educational Data Using Ensemble Machine Learning Algorithms

Webology ◽  
2021 ◽  
Vol 18 (Special Issue 01) ◽  
pp. 183-195
Author(s):  
Thingbaijam Lenin ◽  
N. Chandrasekaran
Keyword(s):  
Machine Learning ◽  
Random Forest ◽  
Missing Values ◽  
Machine Learning Techniques ◽  
Gradient Boosting ◽  
Adaptive Boosting ◽  
Stochastic Gradient Boosting ◽  
Ensemble Machine Learning ◽  
Learning Techniques ◽  
Student’S Performance

Student’s academic performance is one of the most important parameters for evaluating the standard of any institute. It has become a paramount importance for any institute to identify the student at risk of underperforming or failing or even drop out from the course. Machine Learning techniques may be used to develop a model for predicting student’s performance as early as at the time of admission. The task however is challenging as the educational data required to explore for modelling are usually imbalanced. We explore ensemble machine learning techniques namely bagging algorithm like random forest (rf) and boosting algorithms like adaptive boosting (adaboost), stochastic gradient boosting (gbm), extreme gradient boosting (xgbTree) in an attempt to develop a model for predicting the student’s performance of a private university at Meghalaya using three categories of data namely demographic, prior academic record, personality. The collected data are found to be highly imbalanced and also consists of missing values. We employ k-nearest neighbor (knn) data imputation technique to tackle the missing values. The models are developed on the imputed data with 10 fold cross validation technique and are evaluated using precision, specificity, recall, kappa metrics. As the data are imbalanced, we avoid using accuracy as the metrics of evaluating the model and instead use balanced accuracy and F-score. We compare the ensemble technique with single classifier C4.5. The best result is provided by random forest and adaboost with F-score of 66.67%, balanced accuracy of 75%, and accuracy of 96.94%.

scholarly journals Machine learning as a successful approach for predicting complex spatio–temporal patterns in animal species abundance

2021 ◽  
pp. 289-301
Author(s):  
B. Martín ◽  
J. González–Arias ◽  
J. A. Vicente–Vírseda
Keyword(s):  
Machine Learning ◽  
Random Forest ◽  
Animal Species ◽  
Temporal Patterns ◽  
Additive Models ◽  
Gradient Boosting ◽  
Support Vector ◽  
Stochastic Gradient Boosting ◽  
Extreme Gradient Boosting ◽  
Spatio Temporal

Our aim was to identify an optimal analytical approach for accurately predicting complex spatio–temporal patterns in animal species distribution. We compared the performance of eight modelling techniques (generalized additive models, regression trees, bagged CART, k–nearest neighbors, stochastic gradient boosting, support vector machines, neural network, and random forest –enhanced form of bootstrap. We also performed extreme gradient boosting –an enhanced form of radiant boosting– to predict spatial patterns in abundance of migrating Balearic shearwaters based on data gathered within eBird. Derived from open–source datasets, proxies of frontal systems and ocean productivity domains that have been previously used to characterize the oceanographic habitats of seabirds were quantified, and then used as predictors in the models. The random forest model showed the best performance according to the parameters assessed (RMSE value and R2). The correlation between observed and predicted abundance with this model was also considerably high. This study shows that the combination of machine learning techniques and massive data provided by open data sources is a useful approach for identifying the long–term spatial–temporal distribution of species at regional spatial scales.

Predictive Credit Risk Analytics Using Borrowers' Digital Footprint and Methods of Statistical Machine Learning

2021 ◽  
Vol 12 (7) ◽  
pp. 358-372
Author(s):  
E. V. Orlova ◽  
Keyword(s):  
Machine Learning ◽  
Credit Risk ◽  
Risk Profile ◽  
Classification Model ◽  
Gradient Boosting ◽  
Suggested Approach ◽  
Digital Footprint ◽  
Credit Risks ◽  
Stochastic Gradient Boosting ◽  
Boosting Method

The article considers the problem of reducing the banks credit risks associated with the insolvency of borrowers — individuals using financial, socio-economic factors and additional data about borrowers digital footprint. A critical analysis of existing approaches, methods and models in this area has been carried out and a number of significant shortcomings identified that limit their application. There is no comprehensive approach to identifying a borrowers creditworthiness based on information, including data from social networks and search engines. The new methodological approach for assessing the borrowers risk profile based on the phased processing of quantitative and qualitative data and modeling using methods of statistical analysis and machine learning is proposed. Machine learning methods are supposed to solve clustering and classification problems. They allow to automatically determine the data structure and make decisions through flexible and local training on the data. The method of hierarchical clustering and the k-means method are used to identify similar social, anthropometric and financial indicators, as well as indicators characterizing the digital footprint of borrowers, and to determine the borrowers risk profile over group. The obtained homogeneous groups of borrowers with a unique risk profile are further used for detailed data analysis in the predictive classification model. The classification model is based on the stochastic gradient boosting method to predict the risk profile of a potencial borrower. The suggested approach for individuals creditworthiness assessing will reduce the banks credit risks, increase its stability and profitability. The implementation results are of practical importance. Comparative analysis of the effectiveness of the existing and the proposed methodology for assessing credit risk showed that the new methodology provides predictive ana­lytics of heterogeneous information about a potential borrower and the accuracy of analytics is higher. The proposed techniques are the core for the decision support system for justification of individuals credit conditions, minimizing the aggregate credit risks.

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