scholarly journals EnGN: A High-Throughput and Energy-Efficient Accelerator for Large Graph Neural Networks

2021 ◽  
pp. 1-1 ◽  
Author(s):  
Shengwen Liang ◽  
Ying Wang ◽  
Cheng Liu ◽  
Lei He ◽  
Huawei LI ◽  
...  
2021 ◽  
Author(s):  
Viola Fanfani ◽  
Ramon Vinas Torne ◽  
Pietro Lio' ◽  
Giovanni Stracquadanio

The identification of genes and pathways responsible for the transformation of normal cellsinto malignant ones represents a pivotal step to understand the aetiology of cancer, to characterise progression and relapse, and to ultimately design targeted therapies. The advent of high-throughput omic technologies has enabled the discovery of a significant number of cancer driver genes, but recent genomic studies have shown these to be only necessary but not sufficient to trigger tumorigenesis. Since most biological processes are the results of the interaction of multiple genes, it is then conceivable that tumorigenesis is likely the result of the action of networks of cancer driver and non-driver genes. Here we take advantage of recent advances in graph neural networks, combined with well established statistical models of network structure, to build a new model, called Stochastic Block Model Graph Neural Network (SBM-GNN), which predicts cancer driver genes and cancer mediating pathways directly from high-throughput omic experiments. Experimental analysis of synthetic datasets showed that our model can correctly predict genes associated with cancer and recover relevant pathways, while outperforming other state-of-the-art methods. Finally, we used SBM-GNN to perform a pan-cancer analysis, where we found genes and pathways directly involved with the hallmarks of cancer controlling genome stability, apoptosis, immune response, and metabolism.


2020 ◽  
Author(s):  
Artur Schweidtmann ◽  
Jan Rittig ◽  
Andrea König ◽  
Martin Grohe ◽  
Alexander Mitsos ◽  
...  

<div>Prediction of combustion-related properties of (oxygenated) hydrocarbons is an important and challenging task for which quantitative structure-property relationship (QSPR) models are frequently employed. Recently, a machine learning method, graph neural networks (GNNs), has shown promising results for the prediction of structure-property relationships. GNNs utilize a graph representation of molecules, where atoms correspond to nodes and bonds to edges containing information about the molecular structure. More specifically, GNNs learn physico-chemical properties as a function of the molecular graph in a supervised learning setup using a backpropagation algorithm. This end-to-end learning approach eliminates the need for selection of molecular descriptors or structural groups, as it learns optimal fingerprints through graph convolutions and maps the fingerprints to the physico-chemical properties by deep learning. We develop GNN models for predicting three fuel ignition quality indicators, i.e., the derived cetane number (DCN), the research octane number (RON), and the motor octane number (MON), of oxygenated and non-oxygenated hydrocarbons. In light of limited experimental data in the order of hundreds, we propose a combination of multi-task learning, transfer learning, and ensemble learning. The results show competitive performance of the proposed GNN approach compared to state-of-the-art QSPR models making it a promising field for future research. The prediction tool is available via a web front-end at www.avt.rwth-aachen.de/gnn.</div>


2020 ◽  
Author(s):  
Zheng Lian ◽  
Jianhua Tao ◽  
Bin Liu ◽  
Jian Huang ◽  
Zhanlei Yang ◽  
...  

Author(s):  
Alexander D. Pisarev

This article studies the implementation of some well-known principles of information work of biological systems in the input unit of the neuroprocessor, including spike coding of information used in models of neural networks of the latest generation.<br> The development of modern neural network IT gives rise to a number of urgent tasks at the junction of several scientific disciplines. One of them is to create a hardware platform&nbsp;— a neuroprocessor for energy-efficient operation of neural networks. Recently, the development of nanotechnology of the main units of the neuroprocessor relies on combined memristor super-large logical and storage matrices. The matrix topology is built on the principle of maximum integration of programmable links between nodes. This article describes a method for implementing biomorphic neural functionality based on programmable links of a highly integrated 3D logic matrix.<br> This paper focuses on the problem of achieving energy efficiency of the hardware used to model neural networks. The main part analyzes the known facts of the principles of information transfer and processing in biological systems from the point of view of their implementation in the input unit of the neuroprocessor. The author deals with the scheme of an electronic neuron implemented based on elements of a 3D logical matrix. A pulsed method of encoding input information is presented, which most realistically reflects the principle of operation of a sensory biological neural system. The model of an electronic neuron for selecting ranges of technological parameters in a real 3D logic matrix scheme is analyzed. The implementation of disjunctively normal forms is shown, using the logic function in the input unit of a neuroprocessor as an example. The results of modeling fragments of electric circuits with memristors of a 3D logical matrix in programming mode are presented.<br> The author concludes that biomorphic pulse coding of standard digital signals allows achieving a high degree of energy efficiency of the logic elements of the neuroprocessor by reducing the number of valve operations. Energy efficiency makes it possible to overcome the thermal limitation of the scalable technology of three-dimensional layout of elements in memristor crossbars.


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