diff --git a/src/Make.sh b/src/Make.sh index d07b27fc3e..3332be92c4 100644 --- a/src/Make.sh +++ b/src/Make.sh @@ -65,7 +65,7 @@ if (test $1 = "style") then style COMMAND_CLASS "" command input style COMPUTE_CLASS compute_ compute modify modify_cuda style DIHEDRAL_CLASS dihedral_ dihedral force - style DUMP_CLASS dump_ dump output + style DUMP_CLASS dump_ dump output write_dump style FIX_CLASS fix_ fix modify style IMPROPER_CLASS improper_ improper force style INTEGRATE_CLASS "" integrate update diff --git a/src/neigh_full.cpp b/src/neigh_full.cpp index 28b8e54f47..9732d734f3 100644 --- a/src/neigh_full.cpp +++ b/src/neigh_full.cpp @@ -101,7 +101,7 @@ void Neighbor::full_nsq(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -198,7 +198,7 @@ void Neighbor::full_nsq_ghost(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -317,7 +317,7 @@ void Neighbor::full_bin(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -428,7 +428,7 @@ void Neighbor::full_bin_ghost(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -567,7 +567,7 @@ void Neighbor::full_multi(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; diff --git a/src/neigh_half_bin.cpp b/src/neigh_half_bin.cpp index e1e892ebb2..9bba2e6ef0 100644 --- a/src/neigh_half_bin.cpp +++ b/src/neigh_half_bin.cpp @@ -110,7 +110,7 @@ void Neighbor::half_bin_no_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -229,7 +229,7 @@ void Neighbor::half_bin_no_newton_ghost(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -365,7 +365,7 @@ void Neighbor::half_bin_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -396,7 +396,7 @@ void Neighbor::half_bin_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -512,7 +512,7 @@ void Neighbor::half_bin_newton_tri(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; diff --git a/src/neigh_half_multi.cpp b/src/neigh_half_multi.cpp index 423e8d107e..08898be3f9 100644 --- a/src/neigh_half_multi.cpp +++ b/src/neigh_half_multi.cpp @@ -118,7 +118,7 @@ void Neighbor::half_multi_no_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -231,7 +231,7 @@ void Neighbor::half_multi_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -268,7 +268,7 @@ void Neighbor::half_multi_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -393,7 +393,7 @@ void Neighbor::half_multi_newton_tri(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; diff --git a/src/neigh_half_nsq.cpp b/src/neigh_half_nsq.cpp index 89f9f8e5c9..3589762a45 100644 --- a/src/neigh_half_nsq.cpp +++ b/src/neigh_half_nsq.cpp @@ -101,7 +101,7 @@ void Neighbor::half_nsq_no_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -207,7 +207,7 @@ void Neighbor::half_nsq_no_newton_ghost(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -339,7 +339,7 @@ void Neighbor::half_nsq_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; diff --git a/src/neigh_respa.cpp b/src/neigh_respa.cpp index cb5a4c48e6..239db4b249 100644 --- a/src/neigh_respa.cpp +++ b/src/neigh_respa.cpp @@ -129,7 +129,7 @@ void Neighbor::respa_nsq_no_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (minchange = domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -307,7 +307,7 @@ void Neighbor::respa_nsq_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (minchange = domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -476,7 +476,7 @@ void Neighbor::respa_bin_no_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (minchange = domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -649,7 +649,7 @@ void Neighbor::respa_bin_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (minchange = domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -693,7 +693,7 @@ void Neighbor::respa_bin_newton(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (minchange = domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j; @@ -871,7 +871,7 @@ void Neighbor::respa_bin_newton_tri(NeighList *list) which = find_special(onemols[imol]->special[iatom], onemols[imol]->nspecial[iatom], tag[j]-tagprev); - else which == 0; + else which = 0; if (which == 0) neighptr[n++] = j; else if (minchange = domain->minimum_image_check(delx,dely,delz)) neighptr[n++] = j;