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Simulated Moving Bed (SMB) chromatography is a well-known technique for the resolution of several high-value-added compounds. Parameters identification and model topology definition are arduous when one is dealing with complex systems such as a Simulated Moving Bed unit. Moreover, the large number of experiments necessary might be an expansive-long process. Hence, this work proposes a novel methodology for parameter estimation, screening the most suitable topology of the models sink-source (defined by the adsorption isotherm equation) and defining the minimum number of experiments necessary to identify the model. Therefore, a nested loop optimization problem is proposed with three levels considering the three main goals of the work: parameters estimation; topology screening by isotherm definition; minimum number of experiments necessary to yield a precise model. The proposed methodology emulated a real scenario by introducing noise in the data and using a Software-in-the-Loop (SIL) approach. Data reconciliation and uncertainty evaluation add robustness to the parameter estimation adding precision and reliability to the model. The methodology is validated considering experimental data from literature apart from the samples applied for parameter estimation, following a cross-validation. The results corroborate that it is possible to carry out trustworthy parameter estimation directly from an SMB unit with minimal system knowledge.

Objective: Parallel imaging accelerates the acquisition of magnetic resonance imaging (MRI) data by acquiring additional sensitivity information with an array of receiver coils resulting in reduced phase encoding steps. Compressed sensing magnetic resonance imaging (CS-MRI) has achieved popularity in the field of medical imaging because of its less data requirement than parallel imaging. Parallel imaging and compressed sensing (CS) both speed up traditional MRI acquisition by minimizing the amount of data captured in the k-space. As acquisition time is inversely proportional to the number of samples, the inverse formation of an image from reduced k-space samples leads to faster acquisition but with aliasing artifacts. This paper proposes a novel Generative Adversarial Network (GAN) namely RECGAN-GR supervised with multi-modal losses for de-aliasing the reconstructed image. Methods: In contrast to existing GAN networks, our proposed method introduces a novel generator network namely RemU-Net integrated with dual-domain loss functions including weighted magnitude and phase loss functions along with parallel imaging-based loss i.e., GRAPPA consistency loss. A k-space correction block is proposed as refinement learning to make the GAN network self-resistant to generating unnecessary data which drives the convergence of the reconstruction process faster. Results: Comprehensive results show that the proposed RECGAN-GR achieves a 4 dB improvement in the PSNR among the GAN-based methods and a 2 dB improvement among conventional state-of-the-art CNN methods available in the literature. Conclusion and significance: The proposed work contributes to significant improvement in the image quality for low retained data leading to 5x or 10x faster acquisition.

Node clustering is a powerful tool in the analysis of networks. We introduce a graph neural network framework to obtain node embeddings for directed networks in a self-supervised manner, including a novel probabilistic imbalance loss, which can be used for network clustering. Here, we propose directed flow imbalance measures, which are tightly related to directionality, to reveal clusters in the network even when there is no density difference between clusters. In contrast to standard approaches in the literature, in this paper, directionality is not treated as a nuisance, but rather contains the main signal. DIGRAC optimizes directed flow imbalance for clustering without requiring label supervision, unlike existing graph neural network methods, and can naturally incorporate node features, unlike existing spectral methods. Extensive experimental results on synthetic data, in the form of directed stochastic block models, and real-world data at different scales, demonstrate that our method, based on flow imbalance, attains state-of-the-art results on directed graph clustering when compared against 10 state-of-the-art methods from the literature, for a wide range of noise and sparsity levels, graph structures and topologies, and even outperforms supervised methods.

Reconstructing 3D objects from 2D images is both challenging for our brains and machine learning algorithms. To support this spatial reasoning task, contextual information about the overall shape of an object is critical. However, such information is not captured by established loss terms (e.g. Dice loss). We propose to complement geometrical shape information by including multi-scale topological features, such as connected components, cycles, and voids, in the reconstruction loss. Our method uses cubical complexes to calculate topological features of 3D volume data and employs an optimal transport distance to guide the reconstruction process. This topology-aware loss is fully differentiable, computationally efficient, and can be added to any neural network. We demonstrate the utility of our loss by incorporating it into SHAPR, a model for predicting the 3D cell shape of individual cells based on 2D microscopy images. Using a hybrid loss that leverages both geometrical and topological information of single objects to assess their shape, we find that topological information substantially improves the quality of reconstructions, thus highlighting its ability to extract more relevant features from image datasets.

Classical results in general equilibrium theory assume divisible goods and convex preferences of market participants. In many real-world markets, participants have non-convex preferences and the allocation problem needs to consider complex constraints. Electricity markets are a prime example. In such markets, Walrasian prices are impossible, and heuristic pricing rules based on the dual of the relaxed allocation problem are used in practice. However, these rules have been criticized for high side-payments and inadequate congestion signals. We show that existing pricing heuristics optimize specific design goals that can be conflicting. The trade-offs can be substantial, and we establish that the design of pricing rules is fundamentally a multi-objective optimization problem addressing different incentives. In addition to traditional multi-objective optimization techniques using weighing of individual objectives, we introduce a novel parameter-free pricing rule that minimizes incentives for market participants to deviate locally. Our findings show how the new pricing rule capitalizes on the upsides of existing pricing rules under scrutiny today. It leads to prices that incur low make-whole payments while providing adequate congestion signals and low lost opportunity costs. Our suggested pricing rule does not require weighing of objectives, it is computationally scalable, and balances trade-offs in a principled manner, addressing an important policy issue in electricity markets.

Temporal action localization aims to predict the boundary and category of each action instance in untrimmed long videos. Most of previous methods based on anchors or proposals neglect the global-local context interaction in entire video sequences. Besides, their multi-stage designs cannot generate action boundaries and categories straightforwardly. To address the above issues, this paper proposes a end-to-end model, called Adaptive Perception transformer (AdaPerFormer for short). Specifically, AdaPerFormer explores a dual-branch attention mechanism. One branch takes care of the global perception attention, which can model entire video sequences and aggregate global relevant contexts. While the other branch concentrates on the local convolutional shift to aggregate intra-frame and inter-frame information through our bidirectional shift operation. The end-to-end nature produces the boundaries and categories of video actions without extra steps. Extensive experiments together with ablation studies are provided to reveal the effectiveness of our design. Our method obtains competitive performance on the THUMOS14 and ActivityNet-1.3 dataset.

A key requirement for the success of supervised deep learning is a large labeled dataset - a condition that is difficult to meet in medical image analysis. Self-supervised learning (SSL) can help in this regard by providing a strategy to pre-train a neural network with unlabeled data, followed by fine-tuning for a downstream task with limited annotations. Contrastive learning, a particular variant of SSL, is a powerful technique for learning image-level representations. In this work, we propose strategies for extending the contrastive learning framework for segmentation of volumetric medical images in the semi-supervised setting with limited annotations, by leveraging domain-specific and problem-specific cues. Specifically, we propose (1) novel contrasting strategies that leverage structural similarity across volumetric medical images (domain-specific cue) and (2) a local version of the contrastive loss to learn distinctive representations of local regions that are useful for per-pixel segmentation (problem-specific cue). We carry out an extensive evaluation on three Magnetic Resonance Imaging (MRI) datasets. In the limited annotation setting, the proposed method yields substantial improvements compared to other self-supervision and semi-supervised learning techniques. When combined with a simple data augmentation technique, the proposed method reaches within 8% of benchmark performance using only two labeled MRI volumes for training, corresponding to only 4% (for ACDC) of the training data used to train the benchmark.

While deep learning strategies achieve outstanding results in computer vision tasks, one issue remains. The current strategies rely heavily on a huge amount of labeled data. In many real-world problems it is not feasible to create such an amount of labeled training data. Therefore, researchers try to incorporate unlabeled data into the training process to reach equal results with fewer labels. Due to a lot of concurrent research, it is difficult to keep track of recent developments. In this survey we provide an overview of often used techniques and methods in image classification with fewer labels. We compare 21 methods. In our analysis we identify three major trends. 1. State-of-the-art methods are scaleable to real world applications based on their accuracy. 2. The degree of supervision which is needed to achieve comparable results to the usage of all labels is decreasing. 3. All methods share common techniques while only few methods combine these techniques to achieve better performance. Based on all of these three trends we discover future research opportunities.

This paper presents SimCLR: a simple framework for contrastive learning of visual representations. We simplify recently proposed contrastive self-supervised learning algorithms without requiring specialized architectures or a memory bank. In order to understand what enables the contrastive prediction tasks to learn useful representations, we systematically study the major components of our framework. We show that (1) composition of data augmentations plays a critical role in defining effective predictive tasks, (2) introducing a learnable nonlinear transformation between the representation and the contrastive loss substantially improves the quality of the learned representations, and (3) contrastive learning benefits from larger batch sizes and more training steps compared to supervised learning. By combining these findings, we are able to considerably outperform previous methods for self-supervised and semi-supervised learning on ImageNet. A linear classifier trained on self-supervised representations learned by SimCLR achieves 76.5% top-1 accuracy, which is a 7% relative improvement over previous state-of-the-art, matching the performance of a supervised ResNet-50. When fine-tuned on only 1% of the labels, we achieve 85.8% top-5 accuracy, outperforming AlexNet with 100X fewer labels.

Many tasks in natural language processing can be viewed as multi-label classification problems. However, most of the existing models are trained with the standard cross-entropy loss function and use a fixed prediction policy (e.g., a threshold of 0.5) for all the labels, which completely ignores the complexity and dependencies among different labels. In this paper, we propose a meta-learning method to capture these complex label dependencies. More specifically, our method utilizes a meta-learner to jointly learn the training policies and prediction policies for different labels. The training policies are then used to train the classifier with the cross-entropy loss function, and the prediction policies are further implemented for prediction. Experimental results on fine-grained entity typing and text classification demonstrate that our proposed method can obtain more accurate multi-label classification results.