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64 Open 126 Closed
64 Open 126 Closed
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Issues list

Bond object reciprocity. bug Something isn't working. high priority Above average priority.
#423 opened Jan 11, 2024 by primaryodors
Read all constants from a configuration file. enhancement New feature or request.
#416 opened Dec 25, 2023 by primaryodors
Side chain clashes in docks. bug Something isn't working. high priority Above average priority.
#415 opened Dec 23, 2023 by primaryodors
2
Small performance opportunity in new Conjugation class. enhancement New feature or request. help wanted Extra attention is requested. low priority Not a show stopper, but should be addressed.
#395 opened Nov 26, 2023 by primaryodors
Model PDBs do not match dock file contents. CRITICAL Something is very wrong.
#379 opened Oct 20, 2023 by primaryodors
Possible mechanism for OR1A1 activation.
#360 opened Sep 18, 2023 by primaryodors
Increase memory robustness. high priority Above average priority.
#356 opened Sep 17, 2023 by primaryodors
4
Possible mechanism for OR51E2 activation by ionones.
#347 opened Sep 5, 2023 by primaryodors
1
Create internal contacts activation .cpp for TAARs.
#334 opened Aug 25, 2023 by primaryodors
@primaryodors
Break molecular interaction test out to separate entry in unit_test_express. good first issue Good for newcomers.
#320 opened Aug 5, 2023 by primaryodors
Add Gα15 and Gα16 to list of G proteins.
#317 opened Aug 3, 2023 by primaryodors
@primaryodors
New prediction method: Optimized.
#316 opened Aug 1, 2023 by primaryodors
@primaryodors
Pepteditor: Update CTNRG to allow omnidirectional optimization.
#315 opened Aug 1, 2023 by primaryodors
@primaryodors
1
Optimized per-ligand active states of receptors. high priority Above average priority.
#313 opened Jul 29, 2023 by primaryodors
@primaryodors
Add PDBx/mmCIF support. help wanted Extra attention is requested. medium priority This should be made working as soon as time permits.
#311 opened Jul 28, 2023 by primaryodors
Create unit test for every Pepteditor command. good first issue Good for newcomers. help wanted Extra attention is requested. high priority Above average priority.
#298 opened Jul 13, 2023 by primaryodors
@primaryodors
Stack, rather than heap, return value pointers. enhancement New feature or request. medium priority This should be made working as soon as time permits.
#295 opened Jul 11, 2023 by primaryodors
Expand the prediction system to include arrestins. low priority Not a show stopper, but should be addressed.
#291 opened Jul 7, 2023 by primaryodors
1
Pepteditor: Helix function is warping side chains. high priority Above average priority.
#282 opened Jun 24, 2023 by electronicsbyjulie
2
Confidence level in predictions. on hold Waiting for something else to be working first.
#280 opened Jun 24, 2023 by electronicsbyjulie
Allow ACVTH.rgn as a valid $metrics_to_process in methods.common.php. on hold Waiting for something else to be working first.
#278 opened Jun 22, 2023 by primaryodors
@primaryodors
Bias by energy in methods_common.php on hold Waiting for something else to be working first.
#277 opened Jun 22, 2023 by primaryodors
@primaryodors
Odorant Binding Proteins medium priority This should be made working as soon as time permits. on hold Waiting for something else to be working first.
#276 opened Jun 22, 2023 by primaryodors
@primaryodors
2
Probability-based conformer search question Further information is requested
#275 opened Jun 19, 2023 by primaryodors
1
The binding pocket of OR5K1 on hold Waiting for something else to be working first.
#274 opened Jun 15, 2023 by electronicsbyjulie
ProTip! Exclude everything labeled bug with -label:bug.