Loading src/MOLECULE/angle_hybrid.cpp +10 −4 Original line number Diff line number Diff line Loading @@ -192,14 +192,20 @@ void AngleHybrid::coeff(int which, int narg, char **arg) if (strcmp(arg[1],keywords[m]) == 0) break; if (m == nstyles) error->all("Angle coeff for hybrid has invalid style"); // set low-level coefficients for each angletype // replace 2nd arg with i, call coeff() with no 1st arg // move 1st arg to 2nd arg // just copy ptrs, since arg[] points into original input line arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); // set setflag and which type maps to which sub-style // if sub-style is NULL for "none", still set setflag for (int i = ilo; i <= ihi; i++) { sprintf(arg[1],"%d",i); map[i] = m; if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); if (styles[m] == NULL) setflag[i] = 1; else setflag[i] = styles[m]->setflag[i]; } Loading src/MOLECULE/bond_hybrid.cpp +10 −4 Original line number Diff line number Diff line Loading @@ -191,14 +191,20 @@ void BondHybrid::coeff(int narg, char **arg) if (strcmp(arg[1],keywords[m]) == 0) break; if (m == nstyles) error->all("Bond coeff for hybrid has invalid style"); // set low-level coefficients for each bondtype // replace 2nd arg with i, call coeff() with no 1st arg // move 1st arg to 2nd arg // just copy ptrs, since arg[] points into original input line arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg if (styles[m]) styles[m]->coeff(narg-1,&arg[1]); // set setflag and which type maps to which sub-style // if sub-style is NULL for "none", still set setflag for (int i = ilo; i <= ihi; i++) { sprintf(arg[1],"%d",i); map[i] = m; if (styles[m]) styles[m]->coeff(narg-1,&arg[1]); setflag[i] = 1; } } Loading src/MOLECULE/dihedral_hybrid.cpp +10 −4 Original line number Diff line number Diff line Loading @@ -194,14 +194,20 @@ void DihedralHybrid::coeff(int which, int narg, char **arg) if (strcmp(arg[1],keywords[m]) == 0) break; if (m == nstyles) error->all("Dihedral coeff for hybrid has invalid style"); // set low-level coefficients for each dihedraltype // replace 2nd arg with i, call coeff() with no 1st arg // move 1st arg to 2nd arg // just copy ptrs, since arg[] points into original input line arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); // set setflag and which type maps to which sub-style // if sub-style is NULL for "none", still set setflag for (int i = ilo; i <= ihi; i++) { sprintf(arg[1],"%d",i); map[i] = m; if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); if (styles[m] == NULL) setflag[i] = 1; else setflag[i] = styles[m]->setflag[i]; } Loading src/MOLECULE/improper_hybrid.cpp +10 −4 Original line number Diff line number Diff line Loading @@ -194,14 +194,20 @@ void ImproperHybrid::coeff(int which, int narg, char **arg) if (strcmp(arg[1],keywords[m]) == 0) break; if (m == nstyles) error->all("Improper coeff for hybrid has invalid style"); // set low-level coefficients for each impropertype // replace 2nd arg with i, call coeff() with no 1st arg // move 1st arg to 2nd arg // just copy ptrs, since arg[] points into original input line arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); // set setflag and which type maps to which sub-style // if sub-style is NULL for "none", still set setflag for (int i = ilo; i <= ihi; i++) { sprintf(arg[1],"%d",i); map[i] = m; if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); if (styles[m] == NULL) setflag[i] = 1; else setflag[i] = styles[m]->setflag[i]; } Loading src/pair_hybrid.cpp +3 −2 Original line number Diff line number Diff line Loading @@ -272,9 +272,10 @@ void PairHybrid::coeff(int narg, char **arg) } // move 1st/2nd args to 2nd/3rd args // just copy ptrs, since arg[] points into original input line sprintf(arg[2],"%s",arg[1]); sprintf(arg[1],"%s",arg[0]); arg[2] = arg[1]; arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg Loading Loading
src/MOLECULE/angle_hybrid.cpp +10 −4 Original line number Diff line number Diff line Loading @@ -192,14 +192,20 @@ void AngleHybrid::coeff(int which, int narg, char **arg) if (strcmp(arg[1],keywords[m]) == 0) break; if (m == nstyles) error->all("Angle coeff for hybrid has invalid style"); // set low-level coefficients for each angletype // replace 2nd arg with i, call coeff() with no 1st arg // move 1st arg to 2nd arg // just copy ptrs, since arg[] points into original input line arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); // set setflag and which type maps to which sub-style // if sub-style is NULL for "none", still set setflag for (int i = ilo; i <= ihi; i++) { sprintf(arg[1],"%d",i); map[i] = m; if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); if (styles[m] == NULL) setflag[i] = 1; else setflag[i] = styles[m]->setflag[i]; } Loading
src/MOLECULE/bond_hybrid.cpp +10 −4 Original line number Diff line number Diff line Loading @@ -191,14 +191,20 @@ void BondHybrid::coeff(int narg, char **arg) if (strcmp(arg[1],keywords[m]) == 0) break; if (m == nstyles) error->all("Bond coeff for hybrid has invalid style"); // set low-level coefficients for each bondtype // replace 2nd arg with i, call coeff() with no 1st arg // move 1st arg to 2nd arg // just copy ptrs, since arg[] points into original input line arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg if (styles[m]) styles[m]->coeff(narg-1,&arg[1]); // set setflag and which type maps to which sub-style // if sub-style is NULL for "none", still set setflag for (int i = ilo; i <= ihi; i++) { sprintf(arg[1],"%d",i); map[i] = m; if (styles[m]) styles[m]->coeff(narg-1,&arg[1]); setflag[i] = 1; } } Loading
src/MOLECULE/dihedral_hybrid.cpp +10 −4 Original line number Diff line number Diff line Loading @@ -194,14 +194,20 @@ void DihedralHybrid::coeff(int which, int narg, char **arg) if (strcmp(arg[1],keywords[m]) == 0) break; if (m == nstyles) error->all("Dihedral coeff for hybrid has invalid style"); // set low-level coefficients for each dihedraltype // replace 2nd arg with i, call coeff() with no 1st arg // move 1st arg to 2nd arg // just copy ptrs, since arg[] points into original input line arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); // set setflag and which type maps to which sub-style // if sub-style is NULL for "none", still set setflag for (int i = ilo; i <= ihi; i++) { sprintf(arg[1],"%d",i); map[i] = m; if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); if (styles[m] == NULL) setflag[i] = 1; else setflag[i] = styles[m]->setflag[i]; } Loading
src/MOLECULE/improper_hybrid.cpp +10 −4 Original line number Diff line number Diff line Loading @@ -194,14 +194,20 @@ void ImproperHybrid::coeff(int which, int narg, char **arg) if (strcmp(arg[1],keywords[m]) == 0) break; if (m == nstyles) error->all("Improper coeff for hybrid has invalid style"); // set low-level coefficients for each impropertype // replace 2nd arg with i, call coeff() with no 1st arg // move 1st arg to 2nd arg // just copy ptrs, since arg[] points into original input line arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); // set setflag and which type maps to which sub-style // if sub-style is NULL for "none", still set setflag for (int i = ilo; i <= ihi; i++) { sprintf(arg[1],"%d",i); map[i] = m; if (styles[m]) styles[m]->coeff(which,narg-1,&arg[1]); if (styles[m] == NULL) setflag[i] = 1; else setflag[i] = styles[m]->setflag[i]; } Loading
src/pair_hybrid.cpp +3 −2 Original line number Diff line number Diff line Loading @@ -272,9 +272,10 @@ void PairHybrid::coeff(int narg, char **arg) } // move 1st/2nd args to 2nd/3rd args // just copy ptrs, since arg[] points into original input line sprintf(arg[2],"%s",arg[1]); sprintf(arg[1],"%s",arg[0]); arg[2] = arg[1]; arg[1] = arg[0]; // invoke sub-style coeff() starting with 1st arg Loading
