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Pull requests: haddocking/haddock3

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Pull requests list

Update installation instructions documentation Improve docs
#1039 opened Sep 20, 2024 by rvhonorato Loading…
3 of 4 tasks
1
@rvhonorato
6
[attract] module feature New feature request m|attract
#1034 opened Sep 18, 2024 by AnnaKravchenko • Draft
1 of 4 tasks
1
@AnnaKravchenko
1
Replace haddock3-analysis-components with haddock3-ui package enhancement Enhancing an existing feature of adding a new one
#1025 opened Sep 16, 2024 by sverhoeven Loading…
2 of 4 tasks
@sverhoeven
15
implement topocg module and helper functions enhancement Enhancing an existing feature of adding a new one m|topocg topocg module
#1007 opened Sep 6, 2024 by rversin • Draft
3 of 12 tasks
@rversin
25
Increase flexibility in incompatibilities handles. bug Something isn't working execution Related to execution modes, such as GRID, HPC, local, etc.
#991 opened Sep 2, 2024 by VGPReys Loading…
12 tasks
1
@VGPReys
4
add DEVELOPMENT.md documentation Improve docs
#988 opened Aug 30, 2024 by rvhonorato • Draft
2
Refactor XYZWriter to not produce intermediate files
#980 opened Aug 27, 2024 by rvhonorato • Draft
12 tasks
Simplify definition of counted parameters by computing them on the fly from definition. CNS Improvements in the CNS engine yaml default parameters Anything related to the YAML configuration files for default parameters
#975 opened Aug 14, 2024 by VGPReys Loading…
10 of 12 tasks
1
@VGPReys
25
Refactor workflow initialization to remove hard dependency on topoaa enhancement Enhancing an existing feature of adding a new one workflow All the general parts of HADDOCK3 not related to any module in particular
#921 opened Jul 3, 2024 by VGPReys Loading…
7 of 12 tasks
1
@VGPReys
38
Voroscoring feature New feature request
#867 opened Apr 18, 2024 by VGPReys • Draft
@VGPReys
sasascore module community contributions from people outside the haddock team enhancement Enhancing an existing feature of adding a new one m|accscoring related to accessibility (a posteriori) scoring
#862 opened Apr 16, 2024 by mgiulini Loading…
9 of 12 tasks
1
@mgiulini
40
z-surface restraints scripts community contributions from people outside the haddock team feature New feature request
#839 opened Mar 27, 2024 by VGPReys Loading…
12 of 16 tasks
1
@VGPReys
26
Add SAXS scoring module feature New feature request m|saxsscore
#551 opened Sep 9, 2022 by cvnoort • Draft
8 of 12 tasks
@cvnoort
3
Add OpenMM module feature New feature request m|openmm Module to work with OpenMM
#482 opened Jun 20, 2022 by joaomcteixeira Loading…
@joaomcteixeira @mgiulini @VGPReys
46
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