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Scalable Multi-GPU Simulation of Long-Range Molecular Dynamics

Marcos Novalbos, Jaime Gonzalez, Miguel A. Otaduy, Roberto Martinez Benito, Alberto Sanchez

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Tags: Algorithms, Biomolecules, Chemistry, CUDA, Electrostatic potential, Electrostatics, FFT, Molecular dynamics, Multilevel summation, N-body simulation, nVidia, nVidia GeForce GTX 580, nVidia GeForce GTX Titan

September 15, 2014 by hgpu

Multilevel summation of electrostatic potentials using graphics processing units

David J. Hardy, John E. Stone, Klaus Schulten

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Tags: Chemistry, CUDA, Electrostatics, Molecular dynamics, Molecular modeling, Multilevel summation, nVidia, nVidia GeForce GTX 280, Physics, Tesla C870, Tesla D870

November 2, 2010 by hgpu

Accelerating molecular modeling applications with graphics processors

John E. Stone, James C. Phillips, Peter L. Freddolino, David J. Hardy, Leonardo G. Trabuco, Klaus Schulten

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Tags: Chemistry, Computational chemistry, CUDA, Electrostatic potential, Molecular dynamics, Molecular modeling, Multilevel summation, nVidia, nVidia GeForce 8800 GTX

October 30, 2010 by hgpu

ArborX: Performance-portable geometric search library

ArborX: A Performance Portable Search Library

FlowSeq: Generative Flow based Sequence-to-Sequence Toolkit

FlowSeq: Non-Autoregressive Conditional Sequence Generation with Generative Flow

Compositional Deep Learning in Futhark

Compositional Deep Learning in Futhark

MLPerf Benchmark Suite

Demystifying the MLPerf Benchmark Suite

stdgpu: Efficient STL-like Data Structures on the GPU

stdgpu: Efficient STL-like Data Structures on the GPU

ikra-cpp: C++ Library for Object-oriented Programming with Structure of Arrays Layout

Memory-Efficient Object-Oriented Programming on GPUs

Mass_Flow_Estimation: Semi-supervised implementation of a DNN for mass prediction from sparsely labeled images

Mass Estimation from Images using Deep Neural Network and Sparse Ground Truth

KNN: k-Nearest Neighbours algorithm

High Performance Computing via High Level Synthesis

SODECL: library of ordinary differential equation (ODE) and stochastic differential equation (SDE) solvers in OpenCL

SODECL: An Open Source Library for Calculating Multiple Orbits of a System of Stochastic Differential Equations in Parallel

sisph: Simple Iterative Incompressible Smoothed Particle Hydrodynamics

Simple Iterative Incompressible Smoothed Particle Hydrodynamics

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2019

May

13-15

Boston, USA

7th International Workshop on OpenCL, 2019

2019

May

13

Boston, MA, USA

Distributed Heterogeneous Programming in C/C++ (DHPCC++), 2019

2019

May

14

Larnaca, Cyprus

3rd International Workshop on Theoretical Approaches to Performance Evaluation, Modeling and Simulation (TAPEMS), 2019

2019

July

26-28

Rome, Italy

International Conference on Frontiers of Neural Networks (ICFNN), 2019

2019

July

26-28

Rome, Italy

International Conference on Frontiers of Artificial Intelligence and Machine Learning (FAIML), 2019

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