Introduce SimulatorBuilder
[gromacs.git] / src / gromacs / nbnxm / locality.h
blob6ebd4fb409b74d8638544114247c4f717f3450c2
1 /*
2 * This file is part of the GROMACS molecular simulation package.
4 * Copyright (c) 2019, by the GROMACS development team, led by
5 * Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
6 * and including many others, as listed in the AUTHORS file in the
7 * top-level source directory and at http://www.gromacs.org.
9 * GROMACS is free software; you can redistribute it and/or
10 * modify it under the terms of the GNU Lesser General Public License
11 * as published by the Free Software Foundation; either version 2.1
12 * of the License, or (at your option) any later version.
14 * GROMACS is distributed in the hope that it will be useful,
15 * but WITHOUT ANY WARRANTY; without even the implied warranty of
16 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
17 * Lesser General Public License for more details.
19 * You should have received a copy of the GNU Lesser General Public
20 * License along with GROMACS; if not, see
21 * http://www.gnu.org/licenses, or write to the Free Software Foundation,
22 * Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
24 * If you want to redistribute modifications to GROMACS, please
25 * consider that scientific software is very special. Version
26 * control is crucial - bugs must be traceable. We will be happy to
27 * consider code for inclusion in the official distribution, but
28 * derived work must not be called official GROMACS. Details are found
29 * in the README & COPYING files - if they are missing, get the
30 * official version at http://www.gromacs.org.
32 * To help us fund GROMACS development, we humbly ask that you cite
33 * the research papers on the package. Check out http://www.gromacs.org.
36 /*! \libinternal \file
37 * \brief Defines nbnxn locality enums
39 * \author Berk Hess <hess@kth.se>
40 * \ingroup module_nbnxm
43 #ifndef GMX_NBNXM_LOCALITY_H
44 #define GMX_NBNXM_LOCALITY_H
46 namespace Nbnxm
49 /*! \brief Atom locality indicator: local, non-local, all.
51 * Used for calls to:
52 * gridding, force calculation, x/f buffer operations
54 enum class AtomLocality : int
56 Local = 0, //!< Local atoms
57 NonLocal = 1, //!< Non-local atoms
58 All = 2, //!< Both local and non-local atoms
59 Count = 3 //!< The number of atom locality types
62 /*! \brief Interaction locality indicator: local, non-local, all.
64 * Used for calls to:
65 * pair-search, force calculation, x/f buffer operations
67 enum class InteractionLocality : int
69 Local = 0, //!< Interactions between local atoms only
70 NonLocal = 1, //!< Interactions between non-local and (non-)local atoms
71 Count = 2 //!< The number of interaction locality types
74 } // namespace Nbnxm
76 #endif // GMX_NBNXM_LOCALITY_H