This paper proposes a deep learning architecture based on Residual Network that dynamically adjusts the number of executed layers for the regions of the image. This architecture is end-to-end trainable, deterministic and problemagnostic. It is therefore applicable without any modifications to a wide range of computer vision problems such as image classification, object detection and image segmentation. We present experimental results showing that this model improves the computational efficiency of Residual Networks on the challenging ImageNet classification and COCO object detection datasets. Additionally, we evaluate the computation time maps on the visual saliency dataset cat2000 and find that they correlate surprisingly well with human eye fixation positions.
Modern computational approaches and machine learning techniques accelerate the invention of new drugs. Generative models can discover novel molecular structures within hours, while conventional drug discovery pipelines require months of work. In this article, we propose a new generative architecture, entangled conditional adversarial autoencoder, that generates molecular structures based on various properties, such as activity against a specific protein, solubility, or ease of synthesis. We apply the proposed model to generate a novel inhibitor of Janus kinase 3, implicated in rheumatoid arthritis, psoriasis, and vitiligo. The discovered molecule was tested in vitro and showed good activity and selectivity.
Many clustering algorithms, including cluster ensembles, rely on a random component. Stability of the results across different runs is considered to be an asset of the algorithm. The cluster ensembles considered here are based on k-means clusterers. Each clusterer is assigned a random target number of clusters, k and is started from a random initialization. Here, we use 10 artificial and 10 real data sets to study ensemble stability with respect to random k, and random initialization. The data sets were chosen to have a small number of clusters (two to seven) and a moderate number of data points (up to a few hundred). Pairwise stability is defined as the adjusted Rand index between pairs of clusterers in the ensemble, averaged across all pairs. Nonpairwise stability is defined as the entropy of the consensus matrix of the ensemble. An experimental comparison with the stability of the standard k-means algorithm was carried out for k from 2 to 20. The results revealed that ensembles are generally more stable, markedly so for larger k. To establish whether stability can serve as a cluster validity index, we first looked at the relationship between stability and accuracy with respect to the number of clusters, k. We found that such a relationship strongly depends on the data set, varying from almost perfect positive correlation (0.97, for the glass data) to almost perfect negative correlation (-0.93, for the crabs data). We propose a new combined stability index to be the sum of the pairwise individual and ensemble stabilities. This index was found to correlate better with the ensemble accuracy. Following the hypothesis that a point of stability of a clustering algorithm corresponds to a structure found in the data, we used the stability measures to pick the number of clusters. The combined stability index gave best results.
Convolutional neural networks excel in image recognition tasks, but this comes at the cost of high computational and memory complexity. To tackle this problem, [1] developed a tensor factorization framework to compress fully-connected layers. In this paper, we focus on compressing convolutional layers. We show that while the direct application of the tensor framework [1] to the 4-dimensional kernel of convolution does compress the layer, we can do better. We reshape the convolutional kernel into a tensor of higher order and factorize it. We combine the proposed approach with the previous work to compress both convolutional and fully-connected layers of a network and achieve 80× network compression rate with 1.1% accuracy drop on the CIFAR-10 dataset.
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