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remove unnecessary check

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because it breaks create_atoms feature
This commit is contained in:
Jacob Gissinger
2020-10-05 23:16:46 -04:00
parent 61c51847c2
commit ccb7a6ee11
1 changed files with 0 additions and 21 deletions
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21
src/USER-REACTION/fix_bond_react.cpp
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@ -2726,27 +2726,6 @@ void FixBondReact::update_everything()
}
}
//maybe add check that all 1-3 neighbors of a local atoms are at least ghosts -> unneeded --jg
//okay, here goes:
//for (int i = 0; i < update_num_mega; i++) {
// rxnID = update_mega_glove[0][i];
// twomol = atom->molecules[reacted_mol[rxnID]];
// for (int j = 0; j < twomol->natoms; j++) {
// int jj = equivalences[j][1][rxnID]-1;
// int jlocal = atom->map(update_mega_glove[jj+1][i]);
// if (jlocal < nlocal && jlocal >= 0) {
// if (landlocked_atoms[j][rxnID] == 1) {
// for (int k = 0; k < nspecial[jlocal][2]; k++) {
// if (atom->map(special[jlocal][k]) < 0 && create_atoms[j][rxnID] == 0) {
// //error->all(FLERR,"Bond/react: Fix bond/react needs ghost atoms from further away - most likely too many processors");
// printf("local is %d other is %d on %d\n", update_mega_glove[jj+1][i],special[jlocal][k],me);
// }
// }
// }
// }
// }
//}
int insert_num;
// very nice and easy to completely overwrite special bond info for landlocked atoms
for (int i = 0; i < update_num_mega; i++) {