/*
* This file is part of the GROMACS molecular simulation package.
*
- * Copyright (c) 2019, by the GROMACS development team, led by
+ * Copyright (c) 2019,2020, by the GROMACS development team, led by
* Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
* and including many others, as listed in the AUTHORS file in the
* top-level source directory and at http://www.gromacs.org.
PairlistParams pairlistParams(kernelSetup.kernelType, false, options.pairlistCutoff, false);
- GridSet gridSet(epbcXYZ, false, nullptr, nullptr, pairlistParams.pairlistType, false,
+ GridSet gridSet(PbcType::Xyz, false, nullptr, nullptr, pairlistParams.pairlistType, false,
numThreads, pinPolicy);
auto pairlistSets = std::make_unique<PairlistSets>(pairlistParams, false, 0);
- auto pairSearch = std::make_unique<PairSearch>(
- epbcXYZ, false, nullptr, nullptr, pairlistParams.pairlistType, false, numThreads, pinPolicy);
+ auto pairSearch =
+ std::make_unique<PairSearch>(PbcType::Xyz, false, nullptr, nullptr,
+ pairlistParams.pairlistType, false, numThreads, pinPolicy);
auto atomData = std::make_unique<nbnxn_atomdata_t>(pinPolicy);