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In drug discovery, molecular dynamics (MD) simulation for protein-ligand binding provides a powerful tool for predicting binding affinities, estimating transport properties, and exploring pocket sites. There has been a long history of…

From logical reasoning to mental simulation, biological and artificial neural systems possess an incredible capacity for computation. Such neural computers offer a fundamentally novel computing paradigm by representing data continuously and…

Disordered Systems and Neural Networks · Physics 2022-03-11 Jason Z. Kim , Dani S. Bassett

We report on the design, verification and performance of mumax3, an open-source GPU-accelerated micromagnetic simulation program. This software solves the time- and space dependent magnetization evolution in nano- to micro scale magnets…

Artificial neural networks and computational neuroscience models have made tremendous progress, allowing computers to achieve impressive results in artificial intelligence (AI) applications, such as image recognition, natural language…

Neural and Evolutionary Computing · Computer Science 2019-11-05 Giacomo Indiveri , Yulia Sandamirskaya

This chapter provides a comprehensive survey of the researches and motivations for hardware implementation of reservoir computing (RC) on neuromorphic electronic systems. Due to its computational efficiency and the fact that training…

Emerging Technologies · Computer Science 2020-08-27 Fatemeh Hadaeghi

Graph Neural Networks (GNNs) are emerging ML models to analyze graph-structure data. Graph Neural Network (GNN) execution involves both compute-intensive and memory-intensive kernels, the latter dominates the total time, being significantly…

With an ever-growing number of parameters defining increasingly complex networks, Deep Learning has led to several breakthroughs surpassing human performance. As a result, data movement for these millions of model parameters causes a…

Neural and Evolutionary Computing · Computer Science 2023-04-12 Christopher Wolters , Brady Taylor , Edward Hanson , Xiaoxuan Yang , Ulf Schlichtmann , Yiran Chen

Solving large dense linear systems and eigenvalue problems is a core requirement in many areas of scientific computing, but scaling these operations beyond a single GPU remains challenging within modern programming frameworks. While highly…

Distributed, Parallel, and Cluster Computing · Computer Science 2026-01-22 Roeland Wiersema

The value of neuromorphic computers depends crucially on our ability to program them for relevant tasks. Currently, neuromorphic computers are mostly limited to machine learning methods adapted from deep learning. However, neuromorphic…

Neural and Evolutionary Computing · Computer Science 2023-10-30 Steven Abreu

External control of agent-based models is vital for complex adaptive systems research. Often these experiments require vast numbers of simulation runs and are computationally expensive. NetLogo is the language of choice for most agent-based…

Multiagent Systems · Computer Science 2021-07-16 Chathika Gunaratne , Ivan Garibay

Tuning hyperparameters for machine learning algorithms is a tedious task, one that is typically done manually. To enable automated hyperparameter tuning, recent works have started to use techniques based on Bayesian optimization. However,…

Machine Learning · Computer Science 2020-05-26 Sandeep Singh Sandha , Mohit Aggarwal , Igor Fedorov , Mani Srivastava

Neuromorphic Multiply-And-Accumulate (MAC) circuits utilizing synaptic weight elements based on SRAM or novel Non-Volatile Memories (NVMs) provide a promising approach for highly efficient hardware representations of neural networks. NVM…

Emerging Technologies · Computer Science 2018-09-14 Borna Obradovic , Titash Rakshit , Ryan Hatcher , Jorge A. Kittl , Mark S. Rodder

As robots become smarter and more ubiquitous, optimizing the power consumption of intelligent compute becomes imperative towards ensuring the sustainability of technological advancements. Neuromorphic computing hardware makes use of…

Many problems in computer vision and robotics can be phrased as non-linear least squares optimization problems represented by factor graphs, for example, simultaneous localization and mapping (SLAM), structure from motion (SfM), motion…

Robotics · Computer Science 2019-09-04 Jing Dong , Zhaoyang Lv

Neuromorphic computing (NC) introduces a novel algorithmic paradigm representing a major shift from traditional digital computing of Von Neumann architectures. NC emulates or simulates the neural dynamics of brains in the form of Spiking…

Neural and Evolutionary Computing · Computer Science 2025-05-23 El-ghazali Talbi

The emergence of resistive non-volatile memories opens the way to highly energy-efficient computation near- or in-memory. However, this type of computation is not compatible with conventional ECC, and has to deal with device unreliability.…

Emerging Technologies · Computer Science 2020-07-14 Marc Bocquet , Tifenn Hirtzlin , Jacques-Olivier Klein , Etienne Nowak , Elisa Vianello , Jean-Michel Portal , Damien Querlioz

Open-source simulation tools play a crucial role for neuromorphic application engineers and hardware architects to investigate performance bottlenecks and explore design optimizations before committing to silicon. Reconfigurable…

Emerging Technologies · Computer Science 2024-04-26 Sahil Hassan , Michael Inouye , Miguel C. Gonzalez , Ilkin Aliyev , Joshua Mack , Maisha Hafiz , Ali Akoglu

With the advancement of deep learning technology, neural networks have demonstrated their excellent ability to provide accurate predictions in many tasks. However, a lack of consideration for neural network calibration will not gain trust…

Machine Learning · Computer Science 2022-11-30 Lei Hsiung , Yung-Chen Tang , Pin-Yu Chen , Tsung-Yi Ho

We present TensorCircuit-NG, a next-generation quantum software platform designed to bridge the gap between quantum physics, artificial intelligence, and high-performance computing. Moving beyond the scope of traditional circuit simulators,…

We propose an approximate strategy to efficiently train neural network based language models over very large vocabularies. Our approach, called adaptive softmax, circumvents the linear dependency on the vocabulary size by exploiting the…

Computation and Language · Computer Science 2017-06-20 Edouard Grave , Armand Joulin , Moustapha Cissé , David Grangier , Hervé Jégou