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Merge pull request #608 from avcopan/dev
docs #202: Commit f70693d pushed by avcopan
January 17, 2025 20:20 50s dev
dev
January 17, 2025 20:20 50s
Adjust vibrational amplitude for mode visibility
docs #201: Pull request #608 opened by avcopan
January 17, 2025 19:33 59s avcopan:dev
January 17, 2025 19:33 59s
Merge pull request #607 from avcopan/dev
docs #200: Commit f561be0 pushed by avcopan
January 16, 2025 21:25 36s dev
dev
January 16, 2025 21:25 36s
New: Reaction class SMARTS for enumeration
docs #199: Pull request #607 opened by avcopan
January 16, 2025 21:01 37s avcopan:dev
January 16, 2025 21:01 37s
Merge pull request #606 from avcopan/dev
docs #198: Commit f07a21b pushed by avcopan
January 16, 2025 16:04 50s dev
dev
January 16, 2025 16:04 50s
Fix: Reaction enumeration key mapping
docs #197: Pull request #606 opened by avcopan
January 16, 2025 15:41 1m 1s avcopan:dev
January 16, 2025 15:41 1m 1s
Merge pull request #605 from avcopan/dev
docs #196: Commit ce58544 pushed by avcopan
January 6, 2025 16:49 51s dev
dev
January 6, 2025 16:49 51s
New: Normalize joined formulas
docs #195: Pull request #605 opened by avcopan
January 6, 2025 16:24 1m 1s avcopan:dev
January 6, 2025 16:24 1m 1s
Merge pull request #604 from avcopan/dev
docs #194: Commit 0c9606e pushed by avcopan
January 4, 2025 20:20 37s dev
dev
January 4, 2025 20:20 37s
New: Formula sorting + flexibility to use strings
docs #193: Pull request #604 opened by avcopan
January 3, 2025 22:41 37s avcopan:dev
January 3, 2025 22:41 37s
Merge pull request #603 from avcopan/dev
docs #192: Commit e9c65c2 pushed by avcopan
January 3, 2025 21:49 47s dev
dev
January 3, 2025 21:49 47s
Clean: Drop products argument for enumeration
docs #191: Pull request #603 synchronize by avcopan
January 3, 2025 21:18 38s avcopan:dev
January 3, 2025 21:18 38s
Clean: Drop products argument for enumeration
docs #190: Pull request #603 opened by avcopan
January 3, 2025 21:17 48s avcopan:dev
January 3, 2025 21:17 48s
Merge pull request #602 from avcopan/dev
docs #189: Commit a6fbe94 pushed by avcopan
January 3, 2025 18:04 50s dev
dev
January 3, 2025 18:04 50s
New: SMARTS-based enumeration of Reaction objects
docs #188: Pull request #602 opened by avcopan
January 3, 2025 17:40 49s avcopan:dev
January 3, 2025 17:40 49s
Merge pull request #601 from avcopan/dev
docs #187: Commit 0568bcb pushed by avcopan
January 2, 2025 17:06 37s dev
dev
January 2, 2025 17:06 37s
New: Enumerate reactions from SMARTS with RDKit
docs #186: Pull request #601 opened by avcopan
January 2, 2025 16:28 40s avcopan:dev
January 2, 2025 16:28 40s
Merge pull request #600 from lpratalimaffei/dev
docs #185: Commit c0dd064 pushed by lpratalimaffei
December 27, 2024 10:53 41s dev
dev
December 27, 2024 10:53 41s
Dev
docs #184: Pull request #600 opened by lpratalimaffei
December 27, 2024 09:38 37s lpratalimaffei:dev
December 27, 2024 09:38 37s
Merge pull request #599 from lpratalimaffei/dev
docs #183: Commit ac8ada2 pushed by lpratalimaffei
December 27, 2024 09:04 56s dev
dev
December 27, 2024 09:04 56s
Merge pull request #598 from avcopan/dev
docs #181: Commit 825efd2 pushed by avcopan
December 19, 2024 18:39 40s dev
dev
December 19, 2024 18:39 40s
New: Normalize formulas before comparing them
docs #180: Pull request #598 opened by avcopan
December 19, 2024 18:10 40s avcopan:dev
December 19, 2024 18:10 40s
New: Normalize formulas before comparing them
docs #179: Pull request #597 opened by avcopan
December 19, 2024 18:04 38s avcopan:dev
December 19, 2024 18:04 38s
Merge pull request #596 from avcopan/dev
docs #178: Commit 16142ad pushed by avcopan
December 19, 2024 13:50 1m 3s dev
dev
December 19, 2024 13:50 1m 3s