/*
* This file is part of the GROMACS molecular simulation package.
*
- * Copyright (c) 2019,2020, by the GROMACS development team, led by
+ * Copyright (c) 2019,2020,2021, 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.
//! The time constant for the adaptive force scaling in ps
real adaptiveForceScalingTimeConstant_ = 4;
//! Translation of the structure, so that the coordinates that are fitted are x+translation
- std::string translationString_ = "";
+ std::string translationString_;
//! Linear transformation of the structure, so that the coordinates that are fitted are Matrix * x
- std::string transformationMatrixString_ = "";
+ std::string transformationMatrixString_;
};
/*!\brief Check if two structs holding density fitting parameters are equal.