/* -------------------------------------------------------------------------- * * 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) 2008 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 "CudaFreeEnergyPlatform.h" #include "CudaFreeEnergyKernelFactory.h" #include "openmm/freeEnergyKernels.h" #include "kernels/GpuFreeEnergyCudaKernels.h" using namespace OpenMM; #if defined(OPENMM_BUILDING_SHARED_LIBRARY) #if defined(WIN32) #include extern "C" void initOpenMMCudaFreeEnergyPlugin(); BOOL WINAPI DllMain(HANDLE hModule, DWORD ul_reason_for_call, LPVOID lpReserved) { if (ul_reason_for_call == DLL_PROCESS_ATTACH) initOpenMMCudaFreeEnergyPlugin(); return TRUE; } #else extern "C" void __attribute__((constructor)) initOpenMMCudaFreeEnergyPlugin(); #endif #endif using namespace OpenMM; extern "C" void initOpenMMCudaFreeEnergyPlugin() { //(void) fprintf( stderr, "initOpenMMCudaFreeEnergyPlugin called\n"); if ( gpuIsAvailableSoftcore() ){ Platform::registerPlatform(new CudaFreeEnergyPlatform()); } } CudaFreeEnergyPlatform::CudaFreeEnergyPlatform( void ){ CudaFreeEnergyKernelFactory* factory = new CudaFreeEnergyKernelFactory(); registerKernelFactory(CalcNonbondedSoftcoreForceKernel::Name(), factory); registerKernelFactory(CalcGBSAOBCSoftcoreForceKernel::Name(), factory); registerKernelFactory(CalcGBVISoftcoreForceKernel::Name(), factory); }