alfalpha-1.0.0.zip
alfalpha-1.0.0
.gitignore
80 Bytes
LICENSE
35.1 kB
Notes.md
1.5 kB
README.md
3.4 kB
alfa
.gitignore
13 Bytes
__init__.py
0 Bytes
_version.py
464 Bytes
fitting_info.py
2.9 kB
get_model.py
526 Bytes
grids.py
15.3 kB
grids_sMILES.py
10.6 kB
plot_outputs.py
3.2 kB
polynorm.py
1.8 kB
post_process.py
7.8 kB
read_data.py
1.4 kB
setup_params.py
5.4 kB
smoothing.py
24.7 kB
utils.py
3.2 kB
alfa_config.py
8.6 kB
indata
.gitignore
43 Bytes
test.dat
239.5 kB
infiles
.gitignore
33 Bytes
outfiles
.gitignore
33 Bytes
pyproject.toml
901 Bytes
requirements.txt
117 Bytes