Deep learning algorithms are widely used for pattern recognition in electronic noses, which are sensor arrays for gas mixtures. One of the challenges of using electronic noses is sensor drift, which can degrade the accuracy of the system over time, even if it is initially trained to accurately estimate concentrations from sensor data. In this paper, an effective drift compensation method is introduced that adds sensor drift information during training of a neural network that estimates gas concentrations. This is achieved by concatenating a calibration feature vector with sensor data and using this as an input to the neural network. The calibration feature vector is generated via a masked-autoencoder-based feature extractor trained with transfer samples, and acts as a prompt to convey sensor drift information. Our method is tested on a 3-year gas sensor array drift dataset, showing that a neural network using our method performs better than other models, including a network with additional fine tuning, demonstrating that our method is efficient at compensating for sensor drift. In this study, the effectiveness of using prompts for network training is confirmed, which better compensates for drifts in new sensor signals than network fine-tuning.

Raman spectroscopy, which analyzes a Raman scattering spectrum of a target, has emerged as a key technology for non-contact chemical agent (CA) detection. Many CA detection algorithms based on Raman spectroscopy have been studied. However, the baseline, which is caused by fluorescence generated when measuring the Raman scattering spectrum, degrades the performance of CA detection algorithms. Therefore, we propose a baseline correction algorithm that removes the baseline, while minimizing the distortion of the Raman scattering spectrum. Assuming that the baseline is a linear combination of broad Gaussian vectors, we model the measured spectrum as a linear combination of broad Gaussian vectors, bases of background materials and the reference spectra of target CAs. Then, we estimate the baseline and Raman scattering spectrum together using the least squares method. Design parameters of the broad Gaussian vectors are discussed. The proposed algorithm requires reference spectra of target CAs and the background basis matrix. Such prior information can be provided when applying the CA detection algorithm. Via the experiment with real CA spectra measured by the Raman spectrometer, we show that the proposed baseline correction algorithm is more effective for removing the baseline and improving the detection performance, than conventional baseline correction algorithms.

This report describes a radiative transfer model for Fourier transform-infrared (FT-IR) spectroscopy to create close-to-reality toxic gas spectra by reflecting the unique spectral responses of detectors and using the atmospheric radiative transfer code, MODTRAN. This system can be highly useful in overcoming the limitations for measuring toxic gases in open environments. The emulated gas spectra can be used to train support vector machine (SVM) for chemical gas detection. Its detection performance is evaluated with nerve agents (tabun, sarin, soman, and cyclosarin) and a simulant gas (sulfur hexafluoride) for indoor and outdoor experiments by using two off-the-shelf FT-IR gas detectors. The experimental results show that the proposed SVM algorithm successfully detected and classified targeted gases while reducing false negative and false positive detection rates.

Chemical warfare agents pose a serious threat due to their extreme toxicity, necessitating swift the identification of chemical gases and individual responses to the identified threats. Fourier transform infrared (FTIR) spectroscopy offers a method for remote material analysis, particularly in detecting colorless and odorless chemical agents. In this paper, we propose a deep neural network utilizing a semi-supervised autoencoder (SSAE) for the classification of chemical gases based on FTIR spectra. In contrast to traditional methods, the SSAE concurrently trains an autoencoder and a classifier attached to a latent vector of the autoencoder, enhancing feature extraction for classification. The SSAE was evaluated on laboratory-collected FTIR spectra, demonstrating a superior classification performance compared to existing methods. The efficacy of the SSAE lies in its ability to generate denser cluster distributions in latent vectors, thereby enhancing gas classification. This study established a consistent experimental environment for hyperparameter optimization, offering valuable insights into the influence of latent vectors on classification performance.

Target detection and classification by Raman spectroscopy are important techniques for biological and chemical defense in military operations. Conventionally, these techniques preprocess the observed spectra using smoothing or baseline correction and apply detection algorithms like the generalized likelihood ratio test, independent component analysis, nonnegative matrix factorization, etc. These conventional detection algorithms need preprocessing and multiple shots of Raman spectra to get a reasonable accuracy. Recently, techniques based on deep learning are being used for target detection and classification due to its great adaptability and high accuracy over other methods and due to no requirement for preprocessing. Deep learning may give a good performance, but need retraining when untrained class targets are introduced which is time-consuming and bothersome. We devise a novel algorithm using a variant of the pseudo-Siamese network, one of the deep learning algorithms, that does not need retraining to detect and classify untrained class targets. Our algorithm detects and classifies targets with only one shot. In addition, our algorithm does not need preprocessing. We verify our algorithm with Raman spectra measured using a Raman spectrometer.

An interpolation method, which estimates unknown values with constrained information, is based on mathematical calculations. In this study, we addressed interpolation from an image-based perspective and expanded the use of image inpainting to estimate values at unknown points. When chemical gas is dispersed through a chemical attack or terrorism, it is possible to determine the concentration of the gas at each location by utilizing the deployed sensors. By interpolating the concentrations, we can obtain the contours of gas concentration. Accurately distinguishing the contours of a contaminated region from a map enables the optimal response to minimize damage. However, areas with an insufficient number of sensors have less accurate contours than other areas. In order to achieve more accurate contour data, an image inpainting-based method is proposed to enhance reliability by erasing and reconstructing low-accuracy areas in the contour. Partial convolution is used as the machine learning approach for image-inpainting, with the modified loss function for optimization. In order to train the model, we developed a gas diffusion simulation model and generated a gas concentration contour dataset comprising 100,000 contour images. The results of the model were compared to those of Kriging interpolation, one of the conventional spatial interpolation methods, finally demonstrating 13.21% higher accuracy. This suggests that interpolation from an image-based perspective can achieve higher accuracy than numerical interpolation on well-trained data. The proposed method was validated using gas concentration contour data from the verified gas dispersion modeling software Nuclear Biological Chemical Reporting And Modeling System (NBC_RAMS), which was developed by the Agency for Defense Development, South Korea.