/*
* This file is part of the GROMACS molecular simulation package.
*
- * Copyright (c) 2016,2018, by the GROMACS development team, led by
+ * Copyright (c) 2016,2018,2019, 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.
TextWriter::writeFileFromString(runner_.topFileName_, formatString(g_butaneTopFileFormatString, interaction));
runner_.groFileName_ = gmx::test::TestFileManager::getInputFilePath("butane1.gro");
runner_.ndxFileName_ = gmx::test::TestFileManager::getInputFilePath("butane1.ndx");
- /* TODO Now that Verlet is the default, change the implementation
- of useEmptyMdpFile() to do that. */
- runner_.useStringAsMdpFile("");
+ runner_.useEmptyMdpFile();
}
//! Prepare an mdrun caller
CommandLine setupMdrun()