bond/react: make rmsd constraint lowercase

This commit is contained in:
Jacob Gissinger
2020-08-28 11:06:27 -04:00
parent 2686df3760
commit ef50a67169
2 changed files with 15 additions and 15 deletions

View File

@ -3360,7 +3360,7 @@ void FixBondReact::Constraints(char *line, int myrxn)
constraints[nconstraints][4] = tmp[1];
constraints[nconstraints][5] = tmp[2];
constraints[nconstraints][6] = tmp[3];
} else if (strcmp(constraint_type,"RMSD") == 0) {
} else if (strcmp(constraint_type,"rmsd") == 0) {
constraints[nconstraints][1] = RMSD;
strcpy(strargs[0],"0");
sscanf(line,"%*s %lg %s",&tmp[0],strargs[0]);