diff --git a/developer-doc/mdTemplate.txt b/developer-doc/mdTemplate.txt index a9def3db2822f87b03b7c6b17ab40443a488f41e..0c22d01f15d0dd93c783abb1921b328c31efd51f 100644 --- a/developer-doc/mdTemplate.txt +++ b/developer-doc/mdTemplate.txt @@ -183,7 +183,7 @@ plumed plumedmain; plumedmain=plumed_create(); // Create the plu plumed_cmd(plumedmain,"setRealPrecision",&real_precision); // Pass a pointer to an integer containing the size of a real number (4 or 8) plumed_cmd(plumedmain,"setMDEnergyUnits",&energyUnits); // Pass a pointer to the conversion factor between the energy unit used in your code and kJ mol-1 plumed_cmd(plumedmain,"setMDLengthUnits",&lengthUnits); // Pass a pointer to the conversion factor between the length unit used in your code and nm -plumed_cmd(plumedmain,"setMDTimeUnits",&timeUnits); // Pass a pointer to the conversion factor between the time unit used in your code and fs? +plumed_cmd(plumedmain,"setMDTimeUnits",&timeUnits); // Pass a pointer to the conversion factor between the time unit used in your code and ps plumed_cmd(plumedmain,"setPlumedDat",&plumedInput); // Pass the name of the plumed input file from the md code to plumed plumed_cmd(plumedmain,"setMPIComm",&MPI_COMM_WORLD); // Pass a pointer to the MPI communicator to plumed? plumed_cmd(plumedmain,"setNatoms",&natoms); // Pass a pointer to the number of atoms in the system to plumed diff --git a/src/wrapper/Plumed.h b/src/wrapper/Plumed.h index 98a2e124898148c7c8694c6f78b2357565b0364a..f41cb74bb86658d7fd2baecc86569ec79e9be0e6 100644 --- a/src/wrapper/Plumed.h +++ b/src/wrapper/Plumed.h @@ -103,8 +103,8 @@ To check if the global object has been initialized, use \verbatim - (C) plumed_g_initialized - (C++) PLMD::Plumed::g_initialized + (C) plumed_ginitialized + (C++) PLMD::Plumed::ginitialized (FORTRAN) PLUMED_F_GINITIALIZED \endverbatim