| line |
true |
false |
branch |
|
28
|
76 |
79 |
if (ref $what eq "HASH") |
|
34
|
74 |
5 |
ref $what eq 'ARRAY' ? : |
|
37
|
56 |
23 |
unless $order_sub |
|
51
|
0 |
423 |
if ($vertex_symbols{$unseen}) |
|
65
|
42 |
462 |
if &is_chiral($vertex) |
|
76
|
81 |
0 |
if ($order_sub) |
|
86
|
1 |
80 |
if (scalar keys %vertex_symbols != scalar $graph->vertices) |
|
91
|
0 |
81 |
unless @symbols |
|
96
|
2 |
40 |
unless $atom->{'chirality'} =~ /^\@\@?$/ |
|
99
|
1 |
39 |
if (scalar @neighbours < 3 or scalar @neighbours > 4) |
|
109
|
39 |
0 |
if ($atom->{'chirality_neighbours'}) |
|
110
|
0 |
39 |
if (scalar @neighbours != scalar @{$atom->{'chirality_neighbours'};}) |
|
121
|
16 |
132 |
if (scalar @{$atom->{'chirality_neighbours'};} == 3 and $_ != 0) |
|
131
|
35 |
4 |
if ($discovered_from{$atom}) |
|
137
|
1 |
38 |
if ($$rings{$vertex_symbols{$atom}}) |
|
149
|
8 |
31 |
if (scalar @order_new == 3) |
|
151
|
6 |
2 |
if ($discovered_from{$atom}) { } |
|
158
|
7 |
32 |
if (join("", _permutation_order(@order_new)) ne "0123") |
|
159
|
4 |
3 |
$chirality_now eq '@' ? : |
|
176
|
26 |
1324 |
if ($rings->{$i}) |
|
178
|
0 |
28 |
unless (@ring_ids) |
|
184
|
28 |
0 |
$ring_ids[0] < 10 ? : |
|
189
|
3 |
21 |
$rings->{$i}{$j} eq '\\' ? : |
|
|
4 |
24 |
$rings->{$i}{$j} eq '/' ? : |
|
|
28 |
0 |
$ring_ids[0] < 10 ? : |
|
195
|
28 |
1322 |
if ($ring_ends[$i]) |
|
197
|
0 |
28 |
unless ($a == 0) - ($b == 0) |
|
229
|
3 |
577 |
if (exists $vertex->{'isotope'}) |
|
234
|
41 |
539 |
if (&is_chiral($vertex)) |
|
239
|
6 |
574 |
if ($vertex->{'hcount'}) |
|
240
|
4 |
2 |
$vertex->{'hcount'} == 1 ? : |
|
244
|
8 |
572 |
if ($vertex->{'charge'}) |
|
245
|
3 |
5 |
$vertex->{'charge'} > 0 ? : |
|
250
|
0 |
580 |
if ($vertex->{'class'}) |
|
255
|
438 |
142 |
$is_simple ? : |
|
262
|
345 |
134 |
unless ($graph->has_edge_attribute($u, $v, "bond")) |
|
263
|
2 |
343 |
&is_aromatic($u) && &is_aromatic($v) ? : |
|
267
|
91 |
43 |
if $bond ne "/" and $bond ne "\\" |
|
268
|
30 |
13 |
if $u->{'number'} < $v->{'number'} |
|
279
|
3 |
59 |
if (scalar @_ != 4 or &any(sub {
not defined $_ && /^[0-3]$/;
}
, @_) or join(",", sort(@_)) ne "0,1,2,3") |
|
290
|
34 |
25 |
if ($_[0] != 0) |