/* -------------------------------------------------------------------------- * * OpenMM * * -------------------------------------------------------------------------- * * This is part of the OpenMM molecular simulation toolkit originating from * * Simbios, the NIH National Center for Physics-Based Simulation of * * Biological Structures at Stanford, funded under the NIH Roadmap for * * Medical Research, grant U54 GM072970. See https://simtk.org. * * * * Portions copyright (c) 2012-2022 Stanford University and the Authors. * * Authors: Peter Eastman * * Contributors: * * * * This program is free software: you can redistribute it and/or modify * * it under the terms of the GNU Lesser General Public License as published * * by the Free Software Foundation, either version 3 of the License, or * * (at your option) any later version. * * * * This program is distributed in the hope that it will be useful, * * but WITHOUT ANY WARRANTY; without even the implied warranty of * * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the * * GNU Lesser General Public License for more details. * * * * You should have received a copy of the GNU Lesser General Public License * * along with this program. If not, see . * * -------------------------------------------------------------------------- */ #include "CudaArray.h" #include "CudaContext.h" #include "openmm/common/ContextSelector.h" #include #include #include using namespace OpenMM; CudaArray::CudaArray() : pointer(0), ownsMemory(false) { } CudaArray::CudaArray(CudaContext& context, size_t size, int elementSize, const std::string& name) : pointer(0) { initialize(context, size, elementSize, name); } CudaArray::~CudaArray() { if (pointer != 0 && ownsMemory && context->getContextIsValid()) { ContextSelector selector(*context); CUresult result = cuMemFree(pointer); if (result != CUDA_SUCCESS) { std::stringstream str; str<<"Error deleting array "<pointer != 0) throw OpenMMException("CudaArray has already been initialized"); this->context = &dynamic_cast(context); this->size = size; this->elementSize = elementSize; this->name = name; ownsMemory = true; ContextSelector selector(*this->context); CUresult result = cuMemAlloc(&pointer, size*elementSize); if (result != CUDA_SUCCESS) { std::stringstream str; str<<"Error creating array "< getSize()) throw OpenMMException("uploadSubArray: data exceeds range of array"); CUresult result; if (blocking) result = cuMemcpyHtoD(pointer+offset*elementSize, data, elements*elementSize); else result = cuMemcpyHtoDAsync(pointer+offset*elementSize, data, elements*elementSize, context->getCurrentStream()); if (result != CUDA_SUCCESS) { std::stringstream str; str<<"Error uploading array "<getCurrentStream()); if (result != CUDA_SUCCESS) { std::stringstream str; str<<"Error downloading array "<unwrap(dest); CUresult result = cuMemcpyDtoDAsync(cuDest.getDevicePointer(), pointer, size*elementSize, context->getCurrentStream()); if (result != CUDA_SUCCESS) { std::stringstream str; str<<"Error copying array "<