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primaryodors
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primarydock
PrimaryOdors.org molecular docker.
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Minor odorant fixes.
#484
primaryodors
closed
5 days ago
0
Output dock energy as difference between protein-bound ligand and water-solvated ligand energies.
#483
primaryodors
closed
5 days ago
1
Merge overlapping cavities.
#482
primaryodors
closed
1 week ago
1
Fix for terrible mistake in TMR5 of every single OR.
#481
primaryodors
closed
1 week ago
2
Display interactions between ligand and receptor.
#480
primaryodors
closed
1 week ago
0
Display hydrogen bonds in viewer.
#479
primaryodors
closed
1 week ago
0
Fix errors in alignments for homology models.
#478
primaryodors
closed
2 weeks ago
1
Homology models from new consensus ORs.
#477
primaryodors
closed
2 weeks ago
2
Metals aren't binding properly.
#476
primaryodors
closed
3 weeks ago
3
Require Y6.55~D/E45.51 hbond in all active models of receptors that have both residues.
#475
primaryodors
closed
1 week ago
0
Cavity-matching search.
#474
primaryodors
closed
3 weeks ago
3
Bridging fix
#473
primaryodors
closed
1 month ago
1
Binding site info based on mutagenesis and variants data.
#472
primaryodors
closed
1 month ago
0
Fix prediction failures caused by incorrect predock ligand position.
#471
primaryodors
closed
1 month ago
1
Cavity based predictions
#470
primaryodors
closed
1 month ago
0
Mutant forms of receptors.
#469
primaryodors
closed
1 month ago
0
WCLASH new dock result metric.
#468
primaryodors
closed
2 months ago
2
Increase clash limit per atom.
#467
primaryodors
closed
2 months ago
0
Std::vectors have got to go.
#466
primaryodors
closed
2 months ago
2
Correct predictions for valeric and caproic acids in OR51E2.
#465
primaryodors
closed
2 months ago
0
Eclipse energy bugfix.
#464
primaryodors
closed
2 months ago
0
Eclipse energy fix.
#463
primaryodors
closed
2 months ago
0
Job queue fixes.
#462
primaryodors
closed
2 months ago
0
Documentation.
#461
primaryodors
closed
2 months ago
0
Multiple pocket centers.
#460
primaryodors
closed
2 months ago
1
Two part interactions.
#459
primaryodors
closed
2 months ago
0
Cavity search utility
#458
primaryodors
closed
2 months ago
0
Memory leak fix, more active state models, and a few UI improvements.
#457
primaryodors
closed
2 months ago
0
Active models
#456
primaryodors
closed
2 months ago
0
Equilibrium formula
#455
primaryodors
closed
2 months ago
1
Dock optimizations
#454
primaryodors
closed
3 months ago
4
Constrained search mode
#453
primaryodors
closed
3 months ago
4
Generate HM with prediction if missing or out of date.
#452
primaryodors
closed
3 months ago
0
Notes page fix
#451
primaryodors
closed
3 months ago
0
Prediction scoring fix
#450
primaryodors
closed
3 months ago
0
Extra clash coefficient for docking
#449
primaryodors
closed
3 months ago
2
Taar8 bbalign fix
#448
primaryodors
closed
3 months ago
1
Automated Homology Modeling
#447
primaryodors
closed
3 months ago
2
Add HM structure for TAAR8.
#446
primaryodors
closed
3 months ago
0
Soft Docking
#445
primaryodors
closed
3 months ago
2
Redoing same efforts over and over
#444
primaryodors
closed
3 months ago
0
Per-binding-type scoring is wrong.
#443
primaryodors
opened
4 months ago
0
Bond reciprocity
#442
primaryodors
closed
5 months ago
1
Generational algorithm for molecular structures.
#441
primaryodors
closed
5 months ago
1
Add links to ORDB from receptor page.
#440
primaryodors
closed
7 months ago
0
HTTPS for main site.
#439
primaryodors
closed
7 months ago
0
Wang et al OR8D1 and Haag et al OR8H1.
#438
primaryodors
closed
9 months ago
0
Manual active models
#437
primaryodors
opened
9 months ago
1
Include BW numbers in output.
#436
primaryodors
closed
9 months ago
3
Output options
#435
primaryodors
closed
9 months ago
1
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