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Pull requests: marrink-lab/vermouth-martinize

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Pull requests list

Protect angles in helices when adjacent to prolines
#673 opened Mar 5, 2025 by mnmelo Loading…
3
bump image for tests from ubuntu-20.04 to ubuntu-latest
#672 opened Mar 5, 2025 by csbrasnett Loading…
3
improved selections for position restraints
#671 opened Mar 4, 2025 by csbrasnett Loading…
restore napolean_type_aliases with sphinx 8.2.0 -> 8.2.1
#665 opened Feb 24, 2025 by csbrasnett Loading…
1
change posres_fc format
#659 opened Feb 14, 2025 by csbrasnett Loading…
13
Martini3-IDP
#647 opened Jan 9, 2025 by csbrasnett Loading…
25
Rtp parser - Abandon all hope, ye who review here
#631 opened Nov 13, 2024 by pckroon Loading…
6
Autogenerate modification auto-mappings
#604 opened Jun 24, 2024 by pckroon Loading…
15
External EN bonds itp
#596 opened May 8, 2024 by csbrasnett Loading…
7
Issue 584
#595 opened May 6, 2024 by pckroon Loading…
1
Windows issues
#577 opened Mar 7, 2024 by pckroon Loading…
SEQRES parsing
#576 opened Feb 28, 2024 by csbrasnett Loading…
35
First draft of a ProcessorPipeline hacktoberfest-accepted Accepted Hacktoberfest contribution
#552 opened Oct 17, 2023 by pckroon Loading…
Add support for oxDNA file parsing
#536 opened Aug 17, 2023 by jan-stevens Loading…
8
Comments
#460 opened Sep 6, 2022 by fgrunewald • Draft
3
Fix/links dict
#443 opened Jul 6, 2022 by fgrunewald Loading…
35
add draft for ff-output
#442 opened Jul 6, 2022 by fgrunewald Loading…
14
(re-)Implement GMX RTP parser using lark-parser
#359 opened Apr 8, 2021 by pckroon • Draft
2
First version of coordinate generatign processor
#328 opened Dec 11, 2020 by Tsjerk Loading…
51
Processor multiprocessing
#233 opened Mar 4, 2020 by mjtadema Loading…
7
ProTip! Exclude everything labeled bug with -label:bug.