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Add additional example .mol files to inst/extdata
test-coverage #152: Pull request #86 synchronize by Aariq
November 16, 2023 17:56 2m 27s eg-mols
November 16, 2023 17:56 2m 27s
Add additional example .mol files to inst/extdata
test-coverage #151: Pull request #86 opened by Aariq
November 16, 2023 17:51 2m 28s eg-mols
November 16, 2023 17:51 2m 28s
Merge pull request #81 from Meredith-Lab/readme-update
test-coverage #150: Commit 91a0f27 pushed by Aariq
November 16, 2023 17:21 6m 16s master
November 16, 2023 17:21 6m 16s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #149: Pull request #73 synchronize by Aariq
November 3, 2023 17:36 7m 55s smarts
November 3, 2023 17:36 7m 55s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #148: Pull request #73 synchronize by Aariq
November 3, 2023 16:28 2m 57s smarts
November 3, 2023 16:28 2m 57s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #147: Pull request #73 synchronize by Aariq
October 31, 2023 15:53 8m 44s smarts
October 31, 2023 15:53 8m 44s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #146: Pull request #73 synchronize by Aariq
October 30, 2023 19:19 2m 33s smarts
October 30, 2023 19:19 2m 33s
Separate out original SIMPOL.1 from modified Meredith et al. methods
test-coverage #145: Pull request #72 synchronize by Aariq
October 30, 2023 19:17 3m 18s meredith-method
October 30, 2023 19:17 3m 18s
move .data go utils.R
test-coverage #144: Commit bb23463 pushed by Aariq
October 30, 2023 19:16 2m 26s master
October 30, 2023 19:16 2m 26s
Merge pull request #84 from Meredith-Lab/get_mol_kegg
test-coverage #143: Commit 174a0ed pushed by Aariq
October 30, 2023 19:13 2m 21s master
October 30, 2023 19:13 2m 21s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #142: Pull request #73 synchronize by Aariq
October 30, 2023 15:21 3m 36s smarts
October 30, 2023 15:21 3m 36s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #141: Pull request #73 synchronize by Aariq
October 30, 2023 14:37 2m 36s smarts
October 30, 2023 14:37 2m 36s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #140: Pull request #73 synchronize by Aariq
October 27, 2023 21:24 3m 49s smarts
October 27, 2023 21:24 3m 49s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #139: Pull request #73 synchronize by Aariq
October 26, 2023 19:57 3m 27s smarts
October 26, 2023 19:57 3m 27s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #138: Pull request #73 synchronize by Aariq
October 26, 2023 19:15 3m 6s smarts
October 26, 2023 19:15 3m 6s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #137: Pull request #73 synchronize by Aariq
October 26, 2023 18:59 3m 3s smarts
October 26, 2023 18:59 3m 3s
Add missing SMARTS strings and correctness tests for get_fx_groups()
test-coverage #136: Pull request #73 synchronize by Aariq
October 26, 2023 18:55 3m 17s smarts
October 26, 2023 18:55 3m 17s
add reminder to check for valid SDFs
test-coverage #135: Commit 5c438d6 pushed by Aariq
October 26, 2023 17:58 3m 23s master
October 26, 2023 17:58 3m 23s
Improvements to get_mol_kegg()
test-coverage #134: Pull request #84 synchronize by Aariq
October 23, 2023 19:38 2m 38s get_mol_kegg
October 23, 2023 19:38 2m 38s
Improvements to get_mol_kegg()
test-coverage #133: Pull request #84 synchronize by Aariq
October 23, 2023 19:26 2m 33s get_mol_kegg
October 23, 2023 19:26 2m 33s
Improvements to get_mol_kegg()
test-coverage #132: Pull request #84 synchronize by Aariq
October 23, 2023 19:18 2m 44s get_mol_kegg
October 23, 2023 19:18 2m 44s
Improvements to get_mol_kegg()
test-coverage #131: Pull request #84 synchronize by Aariq
October 23, 2023 17:01 2m 43s get_mol_kegg
October 23, 2023 17:01 2m 43s
Add vignettes
test-coverage #130: Pull request #80 synchronize by Aariq
October 23, 2023 15:14 2m 54s vignettes
October 23, 2023 15:14 2m 54s
Improvements to get_mol_kegg()
test-coverage #129: Pull request #84 opened by Aariq
October 23, 2023 15:12 2m 29s get_mol_kegg
October 23, 2023 15:12 2m 29s
Add vignettes
test-coverage #128: Pull request #80 synchronize by Aariq
October 23, 2023 14:40 2m 44s vignettes
October 23, 2023 14:40 2m 44s