| cclib/__init__.py |
13 |
0 |
0 |
100% |
| cclib/bridge/__init__.py |
15 |
1 |
0 |
93% |
| cclib/bridge/cclib2ase.py |
98 |
5 |
0 |
95% |
| cclib/bridge/cclib2biopython.py |
16 |
1 |
0 |
94% |
| cclib/bridge/cclib2horton.py |
51 |
14 |
0 |
73% |
| cclib/bridge/cclib2openbabel.py |
46 |
5 |
0 |
89% |
| cclib/bridge/cclib2psi4.py |
12 |
1 |
0 |
92% |
| cclib/bridge/cclib2pyquante.py |
21 |
3 |
0 |
86% |
| cclib/bridge/cclib2pyscf.py |
13 |
1 |
0 |
92% |
| cclib/io/__init__.py |
13 |
0 |
0 |
100% |
| cclib/io/ccio.py |
239 |
68 |
0 |
72% |
| cclib/io/cjsonreader.py |
34 |
1 |
0 |
97% |
| cclib/io/cjsonwriter.py |
141 |
9 |
0 |
94% |
| cclib/io/cmlwriter.py |
56 |
44 |
0 |
21% |
| cclib/io/filereader.py |
12 |
1 |
0 |
92% |
| cclib/io/filewriter.py |
74 |
9 |
0 |
88% |
| cclib/io/moldenwriter.py |
153 |
30 |
0 |
80% |
| cclib/io/wfxwriter.py |
242 |
95 |
0 |
61% |
| cclib/io/xyzreader.py |
41 |
1 |
0 |
98% |
| cclib/io/xyzwriter.py |
47 |
4 |
0 |
91% |
| cclib/method/__init__.py |
19 |
0 |
0 |
100% |
| cclib/method/bader.py |
86 |
6 |
0 |
93% |
| cclib/method/bickelhaupt.py |
72 |
11 |
0 |
85% |
| cclib/method/calculationmethod.py |
24 |
0 |
0 |
100% |
| cclib/method/cda.py |
71 |
12 |
0 |
83% |
| cclib/method/cspa.py |
62 |
8 |
0 |
87% |
| cclib/method/ddec.py |
358 |
23 |
0 |
94% |
| cclib/method/density.py |
47 |
11 |
0 |
77% |
| cclib/method/electrons.py |
21 |
2 |
0 |
90% |
| cclib/method/fragments.py |
93 |
28 |
0 |
70% |
| cclib/method/hirshfeld.py |
48 |
2 |
0 |
96% |
| cclib/method/lpa.py |
69 |
10 |
0 |
86% |
| cclib/method/mbo.py |
73 |
13 |
0 |
82% |
| cclib/method/moments.py |
57 |
6 |
0 |
89% |
| cclib/method/mpa.py |
63 |
12 |
0 |
81% |
| cclib/method/nuclear.py |
132 |
17 |
0 |
87% |
| cclib/method/opa.py |
77 |
65 |
0 |
16% |
| cclib/method/orbitals.py |
20 |
2 |
0 |
90% |
| cclib/method/population.py |
55 |
5 |
0 |
91% |
| cclib/method/stockholder.py |
93 |
19 |
0 |
80% |
| cclib/method/volume.py |
186 |
41 |
0 |
78% |
| cclib/parser/__init__.py |
19 |
0 |
0 |
100% |
| cclib/parser/adfparser.py |
683 |
15 |
0 |
98% |
| cclib/parser/daltonparser.py |
552 |
5 |
0 |
99% |
| cclib/parser/data.py |
125 |
24 |
0 |
81% |
| cclib/parser/fchkparser.py |
127 |
3 |
0 |
98% |
| cclib/parser/gamessparser.py |
791 |
29 |
0 |
96% |
| cclib/parser/gamessukparser.py |
413 |
6 |
0 |
99% |
| cclib/parser/gaussianparser.py |
1079 |
45 |
0 |
96% |
| cclib/parser/jaguarparser.py |
386 |
5 |
0 |
99% |
| cclib/parser/logfileparser.py |
250 |
36 |
0 |
86% |
| cclib/parser/molcasparser.py |
411 |
14 |
0 |
97% |
| cclib/parser/molproparser.py |
502 |
18 |
0 |
96% |
| cclib/parser/mopacparser.py |
116 |
3 |
0 |
97% |
| cclib/parser/nwchemparser.py |
606 |
17 |
0 |
97% |
| cclib/parser/orcaparser.py |
915 |
71 |
0 |
92% |
| cclib/parser/psi3parser.py |
180 |
169 |
0 |
6% |
| cclib/parser/psi4parser.py |
594 |
16 |
0 |
97% |
| cclib/parser/qchemparser.py |
822 |
14 |
0 |
98% |
| cclib/parser/turbomoleparser.py |
564 |
367 |
0 |
35% |
| cclib/parser/utils.py |
85 |
23 |
0 |
73% |
| cclib/progress/__init__.py |
4 |
1 |
0 |
75% |
| cclib/progress/qt4progress.py |
23 |
23 |
0 |
0% |
| cclib/progress/textprogress.py |
28 |
23 |
0 |
18% |
| cclib/scripts/__init__.py |
3 |
0 |
0 |
100% |
| cclib/scripts/ccframe.py |
41 |
18 |
0 |
56% |
| cclib/scripts/ccget.py |
121 |
44 |
0 |
64% |
| cclib/scripts/ccwrite.py |
53 |
8 |
0 |
85% |
| cclib/scripts/cda.py |
35 |
29 |
0 |
17% |
