@@ -3,20 +3,20 @@ import Logging
3
3
Logging. disable_logging (Logging. Warn)
4
4
using PythonCall
5
5
pyimport (" sys" ). path. append (" " )
6
- const Chem = pynew ()
7
- const Desc = pynew ()
8
- const molecule = pynew ()
9
- const chemkin = pynew ()
10
- const species = pynew ()
11
- const reaction = pynew ()
12
- const nasa = pynew ()
13
- const wilhoit = pynew ()
14
- const arrhenius = pynew ()
15
- const falloff = pynew ()
16
- const chebyshev = pynew ()
17
- const solvation = pynew ()
18
- const fragment = pynew ()
19
- const pydot = pynew ()
6
+ const Chem = PythonCall . pynew ()
7
+ const Desc = PythonCall . pynew ()
8
+ const molecule = PythonCall . pynew ()
9
+ const chemkin = PythonCall . pynew ()
10
+ const species = PythonCall . pynew ()
11
+ const reaction = PythonCall . pynew ()
12
+ const nasa = PythonCall . pynew ()
13
+ const wilhoit = PythonCall . pynew ()
14
+ const arrhenius = PythonCall . pynew ()
15
+ const falloff = PythonCall . pynew ()
16
+ const chebyshev = PythonCall . pynew ()
17
+ const solvation = PythonCall . pynew ()
18
+ const fragment = PythonCall . pynew ()
19
+ const pydot = PythonCall . pynew ()
20
20
function __init__ ()
21
21
pycopy! (Chem, pyimport (" rdkit.Chem" ))
22
22
pycopy! (Desc, pyimport (" rdkit.Chem.Descriptors" ))
0 commit comments