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trying again tests... Python Package using Conda #50: Commit 77c3bbf pushed by SantiagoMorandi
October 29, 2023 19:47 7m 55s main
main
October 29, 2023 19:47 7m 55s
cleaned tests Python Package using Conda #49: Commit 9093b1e pushed by SantiagoMorandi
October 29, 2023 19:30 8m 4s main
main
October 29, 2023 19:30 8m 4s
installed pytest Python Package using Conda #48: Commit 1d421b6 pushed by SantiagoMorandi
October 29, 2023 18:32 8m 50s main
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October 29, 2023 18:32 8m 50s
commented problematic funcs to fix workflow Python Package using Conda #47: Commit 91159f0 pushed by SantiagoMorandi
October 29, 2023 18:16 8m 38s main
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October 29, 2023 18:16 8m 38s
reomved duplicated gnn folder Python Package using Conda #46: Commit f9df82b pushed by SantiagoMorandi
October 29, 2023 18:10 9m 2s main
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October 29, 2023 18:10 9m 2s
trying to fix github workflow Python Package using Conda #45: Commit b6d31db pushed by SantiagoMorandi
October 29, 2023 17:43 7m 25s main
main
October 29, 2023 17:43 7m 25s
testing workflow Python Package using Conda #44: Commit 799483b pushed by SantiagoMorandi
October 29, 2023 17:30 8m 3s main
main
October 29, 2023 17:30 8m 3s
try github workflow Python Package using Conda #43: Commit 985f742 pushed by SantiagoMorandi
October 29, 2023 17:21 17s main
main
October 29, 2023 17:21 17s
Added script to automatically create conda env Python Package using Conda #42: Commit d7daa35 pushed by SantiagoMorandi
October 29, 2023 17:18 23s main
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October 29, 2023 17:18 23s
adjusted cpu parallelization energy eval Python Package using Conda #41: Commit 27a5fa0 pushed by oliverlovros
October 26, 2023 16:51 22s main
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October 26, 2023 16:51 22s
fixed output_dir v2 Python Package using Conda #40: Commit 1abb944 pushed by oliverlovros
October 26, 2023 16:50 22s main
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October 26, 2023 16:50 22s
Removed unnecessary files dockonsurf Python Package using Conda #39: Commit d333001 pushed by oliverlovros
October 26, 2023 16:28 28s main
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October 26, 2023 16:28 28s
cleaned functions.py, fixed issue output_dir Python Package using Conda #38: Commit 4e60a68 pushed by oliverlovros
October 26, 2023 15:59 29s main
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October 26, 2023 15:59 29s
new gif for README Python Package using Conda #37: Commit 6101808 pushed by SantiagoMorandi
October 26, 2023 15:04 24s main
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October 26, 2023 15:04 24s
output dir automatically generated Python Package using Conda #36: Commit 0faa695 pushed by oliverlovros
October 26, 2023 14:19 29s main
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October 26, 2023 14:19 29s
removed distances from Bond class Python Package using Conda #35: Commit b532d8a pushed by SantiagoMorandi
October 26, 2023 13:01 26s main
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October 26, 2023 13:01 26s
added tmp bool for 4ternary C structures removal Python Package using Conda #34: Commit 84ea7d8 pushed by oliverlovros
October 26, 2023 12:46 26s main
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October 26, 2023 12:46 26s
moved Bond and BondPackage classes to separate module bond.py Python Package using Conda #33: Commit 039127b pushed by SantiagoMorandi
October 26, 2023 12:33 28s main
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October 26, 2023 12:33 28s
Added documentation to alkane generation Python Package using Conda #32: Commit 71327c0 pushed by oliverlovros
October 26, 2023 09:24 22s main
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October 26, 2023 09:24 22s
Improved alkane generation Python Package using Conda #31: Commit 082e170 pushed by oliverlovros
October 26, 2023 09:20 22s main
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October 26, 2023 09:20 22s
changed intermediate labeling from 5 to 10 chars Python Package using Conda #30: Commit ca53cff pushed by SantiagoMorandi
October 25, 2023 16:36 25s main
main
October 25, 2023 16:36 25s
Add functionality to set the max n# of Oxygens present in the molecules Python Package using Conda #29: Commit 8a83d96 pushed by oliverlovros
October 25, 2023 14:39 25s main
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October 25, 2023 14:39 25s
added code conversion to int Python Package using Conda #28: Commit fd2d5ce pushed by oliverlovros
October 25, 2023 12:39 26s main
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October 25, 2023 12:39 26s
reduced size of generated objects during net generation Python Package using Conda #27: Commit ee52376 pushed by SantiagoMorandi
October 25, 2023 09:41 25s main
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October 25, 2023 09:41 25s
added pkl to gitignore Python Package using Conda #26: Commit 534878a pushed by SantiagoMorandi
October 25, 2023 08:39 24s main
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October 25, 2023 08:39 24s
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