Tasks for 5th week - Githubissues

volkamerlab / opencadd

A Python library for structural cheminformatics

https://opencadd.readthedocs.io

MIT License

91 stars 18 forks source link

Tasks for 5th week #7

Closed jaimergp closed 4 years ago

jaimergp commented 4 years ago

@pipaj97:

[x] Merge to master
[ ] Documentation (+ @anniepham7)
[x] Talk to Jaime about CLI entry points

@anniepham7:

[x] Convert from functions to classes
[ ] Fix ongoing issues with Jaime
[ ] Documentation (+ @pipaj97)

@Tiggha:

[x] Unify classes (Theseus + TheseusAlign)
[x] Teach @Koesed96 about build.sh
[ ] Learn unit testing and apply that to your branch

@Koesed96:

[x] Working example (sync with @Tiggha)
[ ] Teach unit testing to theothers
[ ] (optional) Come up with appropriate test systems (maybe take a look to testsystems).
- [ ] Identical sequences, different conformations
- [ ] Homologous sequences (>80% similarity)
- [ ] Homologous sequences (>40% similarity)
- [ ] Different length of sequences
- [ ] Example of a small protein that can be overlapped into a bigger one (good partial superposition)