View results by: Directories | Files
| Path | Line Coverage | Function Coverage | Region Coverage |
|---|---|---|---|
src/openbabel/data/chemdrawcdx.h |
0.00% (0/3) |
0.00% (0/1) |
0.00% (0/1) |
src/openbabel/include/openbabel/alias.h |
69.23% (9/13) |
50.00% (4/8) |
63.64% (7/11) |
src/openbabel/include/openbabel/atom.h |
47.52% (48/101) |
59.32% (35/59) |
64.29% (54/84) |
src/openbabel/include/openbabel/base.h |
69.77% (30/43) |
59.09% (13/22) |
74.29% (26/35) |
src/openbabel/include/openbabel/bitvec.h |
83.72% (36/43) |
84.62% (11/13) |
92.31% (36/39) |
src/openbabel/include/openbabel/bond.h |
85.71% (36/42) |
81.25% (26/32) |
76.00% (57/75) |
src/openbabel/include/openbabel/bondtyper.h |
0.00% (0/1) |
0.00% (0/1) |
0.00% (0/1) |
src/openbabel/include/openbabel/builder.h |
0.00% (0/3) |
0.00% (0/3) |
0.00% (0/4) |
src/openbabel/include/openbabel/chargemodel.h |
16.67% (1/6) |
16.67% (1/6) |
16.67% (1/6) |
src/openbabel/include/openbabel/data.h |
6.67% (2/30) |
9.52% (2/21) |
17.39% (4/23) |
src/openbabel/include/openbabel/depict/painter.h |
0.00% (0/60) |
0.00% (0/7) |
0.00% (0/65) |
src/openbabel/include/openbabel/descriptor.h |
3.57% (1/28) |
16.67% (1/6) |
3.85% (1/26) |
src/openbabel/include/openbabel/fingerprint.h |
9.68% (3/31) |
8.33% (1/12) |
6.67% (1/15) |
src/openbabel/include/openbabel/forcefield.h |
1.08% (3/277) |
1.32% (1/76) |
0.65% (1/153) |
src/openbabel/include/openbabel/format.h |
35.00% (7/20) |
33.33% (4/12) |
33.33% (4/12) |
src/openbabel/include/openbabel/generic.h |
4.14% (11/266) |
3.98% (7/176) |
3.79% (8/211) |
src/openbabel/include/openbabel/grid.h |
0.00% (0/116) |
0.00% (0/55) |
0.00% (0/75) |
src/openbabel/include/openbabel/groupcontrib.h |
25.00% (1/4) |
50.00% (1/2) |
83.33% (5/6) |
src/openbabel/include/openbabel/inchiformat.h |
0.00% (0/153) |
0.00% (0/10) |
0.00% (0/47) |
src/openbabel/include/openbabel/internalcoord.h |
0.00% (0/2) |
0.00% (0/1) |
0.00% (0/7) |
src/openbabel/include/openbabel/isomorphism.h |
0.00% (0/11) |
0.00% (0/3) |
0.00% (0/9) |
src/openbabel/include/openbabel/kinetics.h |
0.00% (0/69) |
0.00% (0/23) |
0.00% (0/44) |
src/openbabel/include/openbabel/lineend.h |
52.31% (34/65) |
50.00% (5/10) |
65.79% (25/38) |
src/openbabel/include/openbabel/math/matrix3x3.h |
20.00% (12/60) |
15.38% (2/13) |
5.00% (2/40) |
src/openbabel/include/openbabel/math/spacegroup.h |
0.00% (0/9) |
0.00% (0/7) |
0.00% (0/7) |
src/openbabel/include/openbabel/math/transform3d.h |
0.00% (0/14) |
0.00% (0/5) |
0.00% (0/7) |
src/openbabel/include/openbabel/math/vector3.h |
53.90% (76/141) |
52.38% (22/42) |
54.90% (28/51) |
src/openbabel/include/openbabel/mol.h |
37.23% (35/94) |
36.00% (27/75) |
38.82% (66/170) |
src/openbabel/include/openbabel/molchrg.h |
0.00% (0/9) |
0.00% (0/3) |
0.00% (0/3) |
src/openbabel/include/openbabel/obconversion.h |
4.76% (1/21) |
5.00% (1/20) |
4.35% (1/23) |
src/openbabel/include/openbabel/oberror.h |
14.81% (4/27) |
17.39% (4/23) |
17.39% (4/23) |
src/openbabel/include/openbabel/obiter.h |
6.58% (5/76) |
7.04% (5/71) |
6.76% (5/74) |
src/openbabel/include/openbabel/obmolecformat.h |
84.85% (28/33) |
25.00% (1/4) |
50.00% (3/6) |
src/openbabel/include/openbabel/obutil.h |
0.00% (0/56) |
0.00% (0/14) |
0.00% (0/25) |
src/openbabel/include/openbabel/op.h |
3.03% (1/33) |
25.00% (1/4) |
4.17% (1/24) |
src/openbabel/include/openbabel/parsmart.h |
6.67% (3/45) |
18.75% (3/16) |
18.92% (7/37) |
src/openbabel/include/openbabel/phmodel.h |
0.00% (0/3) |
0.00% (0/3) |
0.00% (0/3) |
src/openbabel/include/openbabel/plugin.h |
65.31% (32/49) |
46.67% (7/15) |
62.16% (23/37) |
src/openbabel/include/openbabel/query.h |
0.00% (0/65) |
0.00% (0/19) |
0.00% (0/40) |
src/openbabel/include/openbabel/reaction.h |
0.00% (0/49) |
0.00% (0/20) |
0.00% (0/27) |
src/openbabel/include/openbabel/residue.h |
0.00% (0/4) |
0.00% (0/4) |
0.00% (0/4) |
src/openbabel/include/openbabel/ring.h |
91.67% (22/24) |
83.33% (10/12) |
88.24% (15/17) |
src/openbabel/include/openbabel/rotamer.h |
0.00% (0/26) |
0.00% (0/8) |
0.00% (0/11) |
src/openbabel/include/openbabel/rotor.h |
0.00% (0/206) |
0.00% (0/65) |
0.00% (0/95) |
src/openbabel/include/openbabel/stereo/cistrans.h |
36.36% (4/11) |
40.00% (2/5) |
66.67% (6/9) |
src/openbabel/include/openbabel/stereo/squareplanar.h |
0.00% (0/11) |
0.00% (0/5) |
0.00% (0/8) |
src/openbabel/include/openbabel/stereo/stereo.h |
80.77% (21/26) |
60.00% (6/10) |
82.61% (19/23) |
src/openbabel/include/openbabel/stereo/tetrahedral.h |
60.00% (9/15) |
60.00% (3/5) |
87.50% (14/16) |
src/openbabel/include/openbabel/stereo/tetranonplanar.h |
50.00% (19/38) |
100.00% (1/1) |
60.87% (14/23) |
src/openbabel/include/openbabel/stereo/tetraplanar.h |
70.00% (21/30) |
100.00% (1/1) |
78.57% (11/14) |
src/openbabel/include/openbabel/text.h |
0.00% (0/19) |
0.00% (0/5) |
0.00% (0/6) |
src/openbabel/include/openbabel/tokenst.h |
0.00% (0/6) |
0.00% (0/2) |
0.00% (0/2) |
src/openbabel/include/openbabel/typer.h |
50.00% (3/6) |
50.00% (3/6) |
50.00% (3/6) |
src/openbabel/src/alias.cpp |
20.00% (53/265) |
30.77% (4/13) |
20.48% (34/166) |
src/openbabel/src/atom.cpp |
13.18% (161/1222) |
30.77% (24/78) |
11.56% (97/839) |
src/openbabel/src/base.cpp |
60.15% (80/133) |
66.67% (10/15) |
62.00% (62/100) |
src/openbabel/src/bitvec.cpp |
32.10% (113/352) |
48.15% (13/27) |
37.67% (110/292) |
src/openbabel/src/bond.cpp |
17.18% (56/326) |
34.78% (8/23) |
11.41% (30/263) |
src/openbabel/src/bondtyper.cpp |
0.00% (0/184) |
0.00% (0/4) |
0.00% (0/125) |
src/openbabel/src/builder.cpp |
5.04% (58/1151) |
5.00% (1/20) |
5.05% (44/872) |
src/openbabel/src/canon.cpp |
0.00% (0/865) |
0.00% (0/38) |
0.00% (0/644) |
src/openbabel/src/chains.cpp |
21.66% (323/1491) |
19.35% (6/31) |
16.32% (183/1121) |
src/openbabel/src/chargemodel.cpp |
0.00% (0/22) |
0.00% (0/2) |
0.00% (0/9) |
src/openbabel/src/charges/fromfile.cpp |
2.33% (2/86) |
25.00% (1/4) |
4.76% (2/42) |
src/openbabel/src/charges/gasteiger.cpp |
10.00% (1/10) |
25.00% (1/4) |
40.00% (2/5) |
src/openbabel/src/charges/mmff94.cpp |
3.70% (1/27) |
25.00% (1/4) |
14.29% (2/14) |
src/openbabel/src/charges/none.cpp |
10.00% (1/10) |
33.33% (1/3) |
33.33% (2/6) |
src/openbabel/src/data.cpp |
9.41% (46/489) |
13.04% (3/23) |
5.04% (21/417) |
src/openbabel/src/depict/depict.cpp |
0.00% (0/871) |
0.00% (0/50) |
0.00% (0/505) |
src/openbabel/src/depict/svgpainter.cpp |
0.00% (0/140) |
0.00% (0/22) |
0.00% (0/66) |
src/openbabel/src/descriptor.cpp |
0.00% (0/370) |
0.00% (0/13) |
0.00% (0/229) |
src/openbabel/src/descriptors/cansmidescriptor.cpp |
4.76% (1/21) |
25.00% (1/4) |
21.43% (3/14) |
src/openbabel/src/descriptors/cmpdfilter.cpp |
5.88% (1/17) |
25.00% (1/4) |
57.14% (4/7) |
src/openbabel/src/descriptors/filters.cpp |
7.04% (5/71) |
27.78% (5/18) |
19.23% (10/52) |
src/openbabel/src/descriptors/groupcontrib.cpp |
0.00% (0/130) |
0.00% (0/4) |
0.00% (0/89) |
src/openbabel/src/descriptors/inchidescriptor.cpp |
2.27% (1/44) |
20.00% (1/5) |
11.11% (3/27) |
src/openbabel/src/descriptors/smartsdescriptors.cpp |
4.55% (1/22) |
25.00% (1/4) |
26.67% (4/15) |
src/openbabel/src/elements.cpp |
25.95% (1287/4959) |
15.38% (2/13) |
21.50% (970/4511) |
src/openbabel/src/fingerprint.cpp |
0.00% (0/290) |
0.00% (0/17) |
0.00% (0/119) |
src/openbabel/src/fingerprints/finger2.cpp |
0.70% (1/143) |
9.09% (1/11) |
3.57% (3/84) |
src/openbabel/src/fingerprints/finger3.cpp |
3.85% (7/182) |
12.50% (1/8) |
5.32% (5/94) |
src/openbabel/src/fingerprints/fingerecfp.cpp |
1.29% (2/155) |
8.33% (1/12) |
5.32% (5/94) |
src/openbabel/src/forcefield.cpp |
0.10% (3/2993) |
0.93% (1/108) |
0.05% (1/2002) |
src/openbabel/src/forcefields/forcefieldgaff.cpp |
0.00% (0/1161) |
0.00% (0/23) |
0.00% (0/868) |
src/openbabel/src/forcefields/forcefieldgaff.h |
28.21% (11/39) |
9.09% (1/11) |
6.67% (2/30) |
src/openbabel/src/forcefields/forcefieldghemical.cpp |
0.00% (0/911) |
0.00% (0/20) |
0.00% (0/660) |
src/openbabel/src/forcefields/forcefieldghemical.h |
30.56% (11/36) |
10.00% (1/10) |
7.69% (2/26) |
src/openbabel/src/forcefields/forcefieldmmff94.cpp |
0.00% (0/3646) |
0.00% (0/74) |
0.00% (0/3160) |
src/openbabel/src/forcefields/forcefieldmmff94.h |
37.04% (20/54) |
8.33% (1/12) |
12.50% (5/40) |
src/openbabel/src/forcefields/forcefielduff.cpp |
0.00% (0/1392) |
0.00% (0/25) |
0.00% (0/1050) |
src/openbabel/src/forcefields/forcefielduff.h |
28.21% (11/39) |
9.09% (1/11) |
6.67% (2/30) |
src/openbabel/src/format.cpp |
13.51% (10/74) |
20.00% (1/5) |
9.23% (6/65) |
src/openbabel/src/formats/APIInterface.cpp |
21.74% (5/23) |
50.00% (2/4) |
40.00% (4/10) |
src/openbabel/src/formats/CSRformat.cpp |
6.06% (6/99) |
22.22% (2/9) |
12.50% (3/24) |
src/openbabel/src/formats/MCDLformat.cpp |
1.82% (21/1152) |
14.29% (3/21) |
0.34% (3/871) |
src/openbabel/src/formats/MNAformat.cpp |
2.36% (7/297) |
25.00% (2/8) |
1.76% (3/170) |
src/openbabel/src/formats/PQSformat.cpp |
2.54% (6/236) |
22.22% (2/9) |
3.39% (4/118) |
src/openbabel/src/formats/abinitformat.cpp |
3.80% (6/158) |
40.00% (2/5) |
4.00% (4/100) |
src/openbabel/src/formats/acesformat.cpp |
6.70% (12/179) |
40.00% (4/10) |
7.34% (8/109) |
src/openbabel/src/formats/acrformat.cpp |
8.14% (7/86) |
28.57% (2/7) |
6.90% (4/58) |
src/openbabel/src/formats/adfformat.cpp |
4.03% (31/770) |
21.74% (10/46) |
4.08% (21/515) |
src/openbabel/src/formats/alchemyformat.cpp |
4.05% (6/148) |
28.57% (2/7) |
5.71% (4/70) |
src/openbabel/src/formats/amberformat.cpp |
9.84% (6/61) |
40.00% (2/5) |
9.38% (3/32) |
src/openbabel/src/formats/aoforceformat.cpp |
1.96% (2/102) |
40.00% (2/5) |
8.33% (4/48) |
src/openbabel/src/formats/balstformat.cpp |
6.00% (6/100) |
33.33% (2/6) |
7.02% (4/57) |
src/openbabel/src/formats/bgfformat.cpp |
3.06% (6/196) |
33.33% (2/6) |
3.64% (4/110) |
src/openbabel/src/formats/boxformat.cpp |
4.29% (6/140) |
33.33% (2/6) |
6.06% (4/66) |
src/openbabel/src/formats/cacaoformat.cpp |
5.00% (12/240) |
33.33% (4/12) |
6.61% (8/121) |
src/openbabel/src/formats/cacheformat.cpp |
6.80% (7/103) |
33.33% (2/6) |
10.34% (3/29) |
src/openbabel/src/formats/carformat.cpp |
6.25% (7/112) |
33.33% (2/6) |
5.56% (3/54) |
src/openbabel/src/formats/castepformat.cpp |
4.51% (6/133) |
33.33% (2/6) |
7.02% (4/57) |
src/openbabel/src/formats/cccformat.cpp |
7.79% (6/77) |
40.00% (2/5) |
7.69% (3/39) |
src/openbabel/src/formats/chem3dformat.cpp |
6.15% (12/195) |
28.57% (4/14) |
7.69% (6/78) |
src/openbabel/src/formats/chemdrawcdx.cpp |
1.01% (6/596) |
7.14% (2/28) |
1.09% (4/366) |
src/openbabel/src/formats/chemdrawct.cpp |
6.19% (6/97) |
33.33% (2/6) |
6.78% (4/59) |
src/openbabel/src/formats/chemkinformat.cpp |
2.27% (16/705) |
10.00% (2/20) |
0.46% (2/437) |
src/openbabel/src/formats/chemtoolformat.cpp |
7.79% (6/77) |
40.00% (2/5) |
9.38% (3/32) |
src/openbabel/src/formats/cifformat.cpp |
0.23% (3/1297) |
2.94% (1/34) |
0.12% (1/857) |
src/openbabel/src/formats/copyformat.cpp |
11.54% (6/52) |
50.00% (2/4) |
23.08% (3/13) |
src/openbabel/src/formats/crkformat.cpp |
3.79% (12/317) |
25.00% (4/16) |
3.24% (6/185) |
src/openbabel/src/formats/cssrformat.cpp |
7.69% (6/78) |
40.00% (2/5) |
9.09% (3/33) |
src/openbabel/src/formats/dlpolyformat.cpp |
4.65% (12/258) |
25.00% (4/16) |
4.65% (6/129) |
src/openbabel/src/formats/dmolformat.cpp |
5.07% (7/138) |
33.33% (2/6) |
4.40% (4/91) |
src/openbabel/src/formats/exyzformat.cpp |
0.84% (3/357) |
16.67% (1/6) |
0.72% (1/138) |
src/openbabel/src/formats/fastaformat.cpp |
4.73% (13/275) |
16.67% (2/12) |
2.48% (4/161) |
src/openbabel/src/formats/fastsearchformat.cpp |
2.85% (14/491) |
28.57% (2/7) |
2.73% (6/220) |
src/openbabel/src/formats/fchkformat.cpp |
1.79% (11/614) |
13.33% (2/15) |
0.93% (3/323) |
src/openbabel/src/formats/featformat.cpp |
7.14% (6/84) |
33.33% (2/6) |
9.52% (4/42) |
src/openbabel/src/formats/fhformat.cpp |
9.09% (6/66) |
40.00% (2/5) |
12.90% (4/31) |
src/openbabel/src/formats/fhiaimsformat.cpp |
5.56% (6/108) |
33.33% (2/6) |
7.41% (4/54) |
src/openbabel/src/formats/fingerprintformat.cpp |
1.29% (2/155) |
33.33% (2/6) |
4.05% (3/74) |
src/openbabel/src/formats/freefracformat.cpp |
1.76% (3/170) |
20.00% (1/5) |
1.56% (1/64) |
src/openbabel/src/formats/gamessformat.cpp |
2.15% (17/791) |
28.57% (4/14) |
1.46% (7/479) |
src/openbabel/src/formats/gausscubeformat.cpp |
1.38% (7/509) |
25.00% (2/8) |
0.98% (2/205) |
src/openbabel/src/formats/gaussformat.cpp |
2.10% (24/1143) |
28.57% (4/14) |
1.24% (8/645) |
src/openbabel/src/formats/gausszmatformat.cpp |
1.07% (3/280) |
14.29% (1/7) |
0.61% (1/163) |
src/openbabel/src/formats/genbankformat.cpp |
11.59% (8/69) |
33.33% (2/6) |
7.27% (4/55) |
src/openbabel/src/formats/ghemicalformat.cpp |
3.00% (6/200) |
33.33% (2/6) |
2.99% (4/134) |
src/openbabel/src/formats/groformat.cpp |
2.17% (6/276) |
16.67% (1/6) |
0.81% (1/124) |
src/openbabel/src/formats/gromos96format.cpp |
9.68% (6/62) |
40.00% (2/5) |
16.00% (4/25) |
src/openbabel/src/formats/gulpformat.cpp |
2.45% (6/245) |
33.33% (2/6) |
2.90% (4/138) |
src/openbabel/src/formats/hinformat.cpp |
2.04% (3/147) |
16.67% (1/6) |
1.28% (1/78) |
src/openbabel/src/formats/jaguarformat.cpp |
4.40% (8/182) |
36.36% (4/11) |
7.00% (7/100) |
src/openbabel/src/formats/lmpdatformat.cpp |
1.90% (8/422) |
40.00% (2/5) |
2.70% (4/148) |
src/openbabel/src/formats/mdlformat.cpp |
55.53% (814/1466) |
50.00% (17/34) |
58.75% (631/1074) |
src/openbabel/src/formats/mdlvalence.h |
95.19% (356/374) |
100.00% (2/2) |
90.79% (868/956) |
src/openbabel/src/formats/mmcifformat.cpp |
0.86% (8/930) |
4.55% (1/22) |
0.21% (1/483) |
src/openbabel/src/formats/mmodformat.cpp |
4.22% (7/166) |
28.57% (2/7) |
3.33% (3/90) |
src/openbabel/src/formats/mol2format.cpp |
1.61% (9/559) |
9.09% (1/11) |
0.26% (1/390) |
src/openbabel/src/formats/moldenformat.cpp |
2.76% (8/290) |
25.00% (2/8) |
2.13% (4/188) |
src/openbabel/src/formats/molproformat.cpp |
5.91% (12/203) |
50.00% (4/8) |
6.96% (8/115) |
src/openbabel/src/formats/molreport.cpp |
7.41% (6/81) |
40.00% (2/5) |
13.64% (3/22) |
src/openbabel/src/formats/mopacformat.cpp |
2.80% (19/679) |
26.67% (4/15) |
1.20% (5/416) |
src/openbabel/src/formats/mpdformat.cpp |
5.81% (9/155) |
25.00% (2/8) |
3.19% (3/94) |
src/openbabel/src/formats/mpqcformat.cpp |
10.81% (12/111) |
40.00% (4/10) |
13.56% (8/59) |
src/openbabel/src/formats/msiformat.cpp |
3.49% (6/172) |
33.33% (2/6) |
3.45% (4/116) |
src/openbabel/src/formats/msmsformat.cpp |
16.22% (6/37) |
25.00% (2/8) |
23.53% (4/17) |
src/openbabel/src/formats/nulformat.cpp |
25.00% (2/8) |
40.00% (2/5) |
50.00% (3/6) |
src/openbabel/src/formats/nwchemformat.cpp |
1.65% (12/729) |
18.18% (4/22) |
1.42% (8/564) |
src/openbabel/src/formats/opendxformat.cpp |
2.97% (6/202) |
25.00% (2/8) |
3.23% (5/155) |
src/openbabel/src/formats/outformat.cpp |
7.83% (9/115) |
40.00% (2/5) |
4.49% (4/89) |
src/openbabel/src/formats/pcmodelformat.cpp |
2.07% (3/145) |
20.00% (1/5) |
1.56% (1/64) |
src/openbabel/src/formats/pdbformat.cpp |
1.11% (9/811) |
7.69% (1/13) |
0.17% (1/599) |
src/openbabel/src/formats/pdbqtformat.cpp |
0.32% (3/937) |
3.57% (1/28) |
0.16% (1/615) |
src/openbabel/src/formats/pointcloudformat.cpp |
3.97% (6/151) |
18.18% (2/11) |
4.76% (4/84) |
src/openbabel/src/formats/povrayformat.cpp |
1.24% (6/482) |
13.33% (2/15) |
2.11% (4/190) |
src/openbabel/src/formats/pqrformat.cpp |
0.70% (3/429) |
10.00% (1/10) |
0.30% (1/332) |
src/openbabel/src/formats/pwscfformat.cpp |
3.37% (6/178) |
33.33% (2/6) |
5.19% (4/77) |
src/openbabel/src/formats/qchemformat.cpp |
4.48% (12/268) |
40.00% (4/10) |
5.19% (8/154) |
src/openbabel/src/formats/reportformat.cpp |
1.95% (6/308) |
18.18% (2/11) |
2.97% (3/101) |
src/openbabel/src/formats/rsmiformat.cpp |
1.71% (3/175) |
10.00% (1/10) |
1.05% (1/95) |
src/openbabel/src/formats/rxnformat.cpp |
1.32% (3/227) |
10.00% (1/10) |
0.47% (1/211) |
src/openbabel/src/formats/shelxformat.cpp |
8.75% (7/80) |
33.33% (2/6) |
6.25% (3/48) |
src/openbabel/src/formats/smilesformat.cpp |
0.67% (20/2975) |
5.33% (4/75) |
0.28% (5/1797) |
src/openbabel/src/formats/smilesvalence.h |
0.00% (0/65) |
0.00% (0/2) |
0.00% (0/55) |
src/openbabel/src/formats/stlformat.cpp |
3.73% (6/161) |
16.67% (2/12) |
3.57% (4/112) |
src/openbabel/src/formats/svgformat.cpp |
2.93% (11/375) |
22.22% (2/9) |
3.85% (8/208) |
src/openbabel/src/formats/textformat.cpp |
6.38% (3/47) |
20.00% (1/5) |
5.88% (1/17) |
src/openbabel/src/formats/thermoformat.cpp |
2.86% (4/140) |
25.00% (1/4) |
1.02% (1/98) |
src/openbabel/src/formats/tinkerformat.cpp |
1.45% (6/413) |
28.57% (2/7) |
1.09% (4/366) |
src/openbabel/src/formats/titleformat.cpp |
12.50% (4/32) |
40.00% (2/5) |
14.29% (3/21) |
src/openbabel/src/formats/turbomoleformat.cpp |
6.48% (7/108) |
28.57% (2/7) |
5.71% (4/70) |
src/openbabel/src/formats/unichemformat.cpp |
6.67% (6/90) |
33.33% (2/6) |
8.89% (4/45) |
src/openbabel/src/formats/vaspformat.cpp |
2.45% (13/530) |
18.18% (2/11) |
1.49% (4/269) |
src/openbabel/src/formats/viewmolformat.cpp |
5.04% (6/119) |
33.33% (2/6) |
5.26% (4/76) |
src/openbabel/src/formats/xedformat.cpp |
5.77% (6/104) |
40.00% (2/5) |
8.00% (4/50) |
src/openbabel/src/formats/xsfformat.cpp |
5.47% (7/128) |
40.00% (2/5) |
5.13% (4/78) |
src/openbabel/src/formats/xyzformat.cpp |
1.48% (3/203) |
16.67% (1/6) |
1.20% (1/83) |
src/openbabel/src/formats/yasaraformat.cpp |
2.21% (6/271) |
8.00% (2/25) |
1.96% (5/255) |
src/openbabel/src/formats/zindoformat.cpp |
3.82% (6/157) |
40.00% (2/5) |
6.78% (4/59) |
src/openbabel/src/generic.cpp |
2.12% (17/800) |
4.81% (5/104) |
2.75% (14/510) |
src/openbabel/src/graphsym.cpp |
80.26% (248/309) |
78.95% (15/19) |
80.98% (132/163) |
src/openbabel/src/grid.cpp |
0.00% (0/350) |
0.00% (0/22) |
0.00% (0/169) |
src/openbabel/src/griddata.cpp |
0.00% (0/103) |
0.00% (0/30) |
0.00% (0/32) |
src/openbabel/src/isomorphism.cpp |
0.00% (0/439) |
0.00% (0/33) |
0.00% (0/308) |
src/openbabel/src/kekulize.cpp |
90.46% (237/262) |
100.00% (13/13) |
88.28% (211/239) |
src/openbabel/src/locale.cpp |
78.12% (25/32) |
66.67% (4/6) |
78.95% (15/19) |
src/openbabel/src/math/matrix3x3.cpp |
1.71% (5/292) |
4.76% (1/21) |
0.85% (1/118) |
src/openbabel/src/math/spacegroup.cpp |
1.69% (8/474) |
5.00% (1/20) |
0.53% (2/380) |
src/openbabel/src/math/transform3d.cpp |
0.00% (0/87) |
0.00% (0/5) |
0.00% (0/69) |
src/openbabel/src/math/vector3.cpp |
25.23% (28/111) |
26.67% (4/15) |
18.87% (10/53) |
src/openbabel/src/mcdlutil.cpp |
0.00% (0/5440) |
0.00% (0/140) |
0.00% (0/4539) |
src/openbabel/src/mol.cpp |
10.84% (325/2998) |
21.88% (28/128) |
10.53% (206/1956) |
src/openbabel/src/molchrg.cpp |
0.00% (0/235) |
0.00% (0/6) |
0.00% (0/110) |
src/openbabel/src/obconversion.cpp |
11.98% (118/985) |
21.54% (14/65) |
15.73% (90/572) |
src/openbabel/src/oberror.cpp |
44.23% (46/104) |
54.55% (6/11) |
50.63% (40/79) |
src/openbabel/src/obfunctions.cpp |
0.00% (0/904) |
0.00% (0/3) |
0.00% (0/1022) |
src/openbabel/src/obiter.cpp |
0.00% (0/706) |
0.00% (0/77) |
0.00% (0/317) |
src/openbabel/src/obmolecformat.cpp |
0.00% (0/368) |
0.00% (0/9) |
0.00% (0/219) |
src/openbabel/src/obutil.cpp |
0.34% (3/878) |
2.86% (1/35) |
0.20% (1/499) |
src/openbabel/src/ops/addinindex.cpp |
6.67% (1/15) |
25.00% (1/4) |
28.57% (2/7) |
src/openbabel/src/ops/addnonpolarh.cpp |
10.00% (1/10) |
25.00% (1/4) |
25.00% (2/8) |
src/openbabel/src/ops/addpolarh.cpp |
10.00% (1/10) |
25.00% (1/4) |
25.00% (2/8) |
src/openbabel/src/ops/canonical.cpp |
4.76% (1/21) |
25.00% (1/4) |
15.38% (2/13) |
src/openbabel/src/ops/deferred.h |
0.00% (0/41) |
0.00% (0/4) |
0.00% (0/19) |
src/openbabel/src/ops/delnonpolarh.cpp |
10.00% (1/10) |
25.00% (1/4) |
25.00% (2/8) |
src/openbabel/src/ops/delpolarh.cpp |
10.00% (1/10) |
25.00% (1/4) |
25.00% (2/8) |
src/openbabel/src/ops/fillUC.cpp |
1.66% (3/181) |
16.67% (1/6) |
1.47% (2/136) |
src/openbabel/src/ops/forcefield.cpp |
1.20% (2/167) |
25.00% (2/8) |
5.63% (4/71) |
src/openbabel/src/ops/gen2D.cpp |
5.00% (1/20) |
25.00% (1/4) |
18.18% (2/11) |
src/openbabel/src/ops/gen3d.cpp |
0.93% (1/108) |
25.00% (1/4) |
2.50% (2/80) |
src/openbabel/src/ops/opisomorph.cpp |
0.00% (0/273) |
0.00% (0/6) |
0.00% (0/175) |
src/openbabel/src/ops/opisomorph.h |
33.33% (1/3) |
33.33% (1/3) |
50.00% (2/4) |
src/openbabel/src/ops/partialcharges.cpp |
7.32% (3/41) |
25.00% (1/4) |
10.00% (2/20) |
src/openbabel/src/ops/readconformers.cpp |
2.04% (1/49) |
20.00% (1/5) |
9.09% (2/22) |
src/openbabel/src/ops/sort.cpp |
4.40% (4/91) |
14.29% (1/7) |
4.55% (2/44) |
src/openbabel/src/ops/xout.cpp |
1.37% (1/73) |
14.29% (1/7) |
4.35% (2/46) |
src/openbabel/src/parsmart.cpp |
40.83% (790/1935) |
59.68% (37/62) |
38.66% (542/1402) |
src/openbabel/src/phmodel.cpp |
0.00% (0/278) |
0.00% (0/9) |
0.00% (0/234) |
src/openbabel/src/plugin.cpp |
10.38% (30/289) |
40.00% (4/10) |
24.05% (19/79) |
src/openbabel/src/query.cpp |
0.00% (0/37) |
0.00% (0/3) |
0.00% (0/20) |
src/openbabel/src/rand.cpp |
0.00% (0/337) |
0.00% (0/16) |
0.00% (0/186) |
src/openbabel/src/rand.h |
0.00% (0/3) |
0.00% (0/1) |
0.00% (0/1) |
src/openbabel/src/reactionfacade.cpp |
0.00% (0/256) |
0.00% (0/29) |
0.00% (0/149) |
src/openbabel/src/residue.cpp |
0.00% (0/878) |
0.00% (0/44) |
0.00% (0/808) |
src/openbabel/src/ring.cpp |
78.18% (387/495) |
68.97% (20/29) |
77.85% (246/316) |
src/openbabel/src/rotamer.cpp |
0.00% (0/455) |
0.00% (0/19) |
0.00% (0/218) |
src/openbabel/src/rotor.cpp |
0.00% (0/758) |
0.00% (0/30) |
0.00% (0/428) |
src/openbabel/src/stereo/cistrans.cpp |
14.03% (39/278) |
47.06% (8/17) |
15.25% (34/223) |
src/openbabel/src/stereo/facade.cpp |
44.80% (56/125) |
29.41% (5/17) |
55.56% (45/81) |
src/openbabel/src/stereo/gen3dstereohelper.cpp |
0.00% (0/51) |
0.00% (0/2) |
0.00% (0/32) |
src/openbabel/src/stereo/perception.cpp |
63.49% (1219/1920) |
66.07% (37/56) |
65.41% (972/1486) |
src/openbabel/src/stereo/squareplanar.cpp |
0.00% (0/174) |
0.00% (0/15) |
0.00% (0/141) |
src/openbabel/src/stereo/stereo.cpp |
13.46% (7/52) |
20.00% (1/5) |
11.11% (5/45) |
src/openbabel/src/stereo/stereoutil.h |
0.00% (0/2) |
0.00% (0/2) |
0.00% (0/2) |
src/openbabel/src/stereo/tetrahedral.cpp |
17.82% (31/174) |
45.45% (5/11) |
17.93% (26/145) |
src/openbabel/src/stereo/tetranonplanar.cpp |
100.00% (5/5) |
100.00% (2/2) |
100.00% (3/3) |
src/openbabel/src/stereo/tetraplanar.cpp |
100.00% (5/5) |
100.00% (2/2) |
100.00% (3/3) |
src/openbabel/src/tokenst.cpp |
45.31% (58/128) |
50.00% (3/6) |
43.59% (34/78) |
src/openbabel/src/transform.cpp |
0.00% (0/177) |
0.00% (0/2) |
0.00% (0/81) |
src/openbabel/src/typer.cpp |
80.42% (534/664) |
81.82% (18/22) |
82.89% (378/456) |
src/openbabel/test/fuzz/fuzz_obconversion.cpp |
83.33% (10/12) |
100.00% (1/1) |
75.00% (3/4) |
Totals |
10.56% (8950/84728) |
19.17% (784/4090) |
11.94% (7002/58646) |