Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials

Neural message passing on molecular graphs is one of the most promising methods for predicting formation energy and other properties of molecules and materials. In this work we extend the neural message passing model with an edge update network which allows the information exchanged between atoms to depend on the hidden state of the receiving atom. We benchmark the proposed model on three publicly available datasets (QM9, The Materials Project and OQMD) and show that the proposed model yields superior prediction of formation energies and other properties on all three datasets in comparison with the best published results. Furthermore we investigate different methods for constructing the graph used to represent crystalline structures and we find that using a graph based on K-nearest neighbors achieves better prediction accuracy than using maximum distance cutoff or the Voronoi tessellation graph

Recent advances in coherent optics. Filtering of spatial frequencies, holography

Applications of coherent light in areas of spatial filtering and holograph

Novel Feature Extraction Methodology with Evaluation in Artificial Neural Networks Based Fingerprint Recognition System

Fingerprint recognition is one of the most common biometric recognition systems that includes feature extraction and decision modules. In this work, these modules are achieved via artificial neural networks and image processing operations. The aim of the work is to define a new method that requires less computational load and storage capacity, can be an alternative to existing methods, has high fault tolerance, convenient for fraud measures, and is suitable for development. In order to extract the feature points called minutia points of each fingerprint sample, Multilayer Perceptron algorithm is used. Furthermore, the center of the fingerprint is also determined using an improved orientation map. The proposed method gives approximate position information of minutiae points with respect to the core point using a fairly simple, orientation map-based method that provides ease of operation, but with the use of artificial neurons with high fault tolerance, this method has been turned to an advantage. After feature extraction, General Regression Neural Network is used for identification. The system algorithm is evaluated in UPEK and FVC2000 database. The accuracies without rejection of bad images for the database are 95.57% and 91.38% for UPEK and FVC2000 respectively

Gender Estimation from Fingerprints Using DWT and Entropy

Gender estimation from fingerprints have wide range of applications, especially in the field of forensics where identifying the gender of a criminal can reduce the list of suspects significantly. Although there have been quite a few research papers in the field of gender estimation from fingerprints most of those experiments used a lot of features but were only able to achieve poor classification results. That being the motivation behind the study we successfully proposed two different approaches for gender estimation from fingerprints and achieved high classification accuracy.;In this study we have developed two different approaches for gender estimation from fingerprints. The dataset used consists of 498 fingerprints of which 260 are male and 238 are female fingerprints. The first approach is based on wavelet analysis and uses features obtained from a six level discrete wavelet transform (DWT). Classification is performed using a decision stump classifier implemented in weka and was able to achieve a classification accuracy of 95.38% using the DWT approach. The second approach uses wavelet packet analysis and extracted the Shannon entropy and log-energy entropy from the coefficients of wavelet packet transform and provided a classification accuracy of 96.59% on the same dataset using decision stump classifier implemented in weka

A Proposed Frequency-Based Feature Selection Method for Cancer Classification

Feature selection method is becoming an essential procedure in data preprocessing step. The feature selection problem can affect the efficiency and accuracy of classification models. Therefore, it also relates to whether a classification model can have a reliable performance. In this study, we compared an original feature selection method and a proposed frequency-based feature selection method with four classification models and three filter-based ranking techniques using a cancer dataset. The proposed method was implemented in WEKA which is an open source software. The performance is evaluated by two evaluation methods: Recall and Receiver Operating Characteristic (ROC). Finally, we found the frequency-based feature selection method performed better than the original ranking method

Improvement of fingerprint retrieval by a statistical classifier

The topics of fingerprint classification, indexing, and retrieval have been studied extensively in the past decades. One problem faced by researchers is that in all publicly available fingerprint databases, only a few fingerprint samples from each individual are available for training and testing, making it inappropriate to use sophisticated statistical methods for recognition. Hence most of the previous works resorted to simple $k$-nearest neighbor ($k$-NN) classification. However, the $k$-NN classifier has the drawbacks of being comparatively slow and less accurate. In this paper, we tackle this problem by first artificially expanding the set of training samples using our previously proposed spatial modeling technique. With the expanded training set, we are then able to employ a more sophisticated classifier such as the Bayes classifier for recognition. We apply the proposed method to the problem of one-to-$N$ fingerprint identification and retrieval. The accuracy and speed are evaluated using the benchmarking FVC 2000, FVC 2002, and NIST-4 databases, and satisfactory retrieval performance is achieved. © 2010 IEEE.published_or_final_versio