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Merge pull request #223 from hjkgrp/ml_utils Pytest #112: Commit db7532f pushed by ralf-meyer
April 19, 2024 20:34 12m 39s master
master
April 19, 2024 20:34 12m 39s
Machine learning utility functions and classes Pytest #111: Pull request #223 opened by ralf-meyer
April 19, 2024 18:20 12m 27s ml_utils
ml_utils
April 19, 2024 18:20 12m 27s
Merge pull request #219 from hjkgrp/cherry_picked_updates Pytest #110: Commit 9c88578 pushed by ralf-meyer
April 19, 2024 16:23 12m 34s master
master
April 19, 2024 16:23 12m 34s
Merge pull request #222 from hjkgrp/MOF_surrounded_sbu Pytest #109: Commit 6cc7430 pushed by gianmarco-terrones
April 19, 2024 11:29 12m 29s master
master
April 19, 2024 11:29 12m 29s
Mof surrounded sbu Pytest #108: Pull request #222 opened by gianmarco-terrones
April 19, 2024 11:01 12m 29s MOF_surrounded_sbu
MOF_surrounded_sbu
April 19, 2024 11:01 12m 29s
update addtoldb Pytest #107: Pull request #220 synchronize by dbkchu
April 18, 2024 00:34 12m 28s dbkchu-pi-ligands
dbkchu-pi-ligands
April 18, 2024 00:34 12m 28s
Cherry picked updates Pytest #106: Pull request #219 synchronize by ralf-meyer
April 17, 2024 20:52 12m 21s cherry_picked_updates
cherry_picked_updates
April 17, 2024 20:52 12m 21s
Cherry picked updates Pytest #105: Pull request #219 synchronize by ralf-meyer
April 17, 2024 20:43 12m 6s cherry_picked_updates
cherry_picked_updates
April 17, 2024 20:43 12m 6s
update addtoldb Pytest #104: Pull request #220 opened by dbkchu
April 17, 2024 18:57 4m 57s dbkchu-pi-ligands
dbkchu-pi-ligands
April 17, 2024 18:57 4m 57s
Cherry picked updates Pytest #103: Pull request #219 synchronize by ralf-meyer
April 17, 2024 17:38 12m 3s cherry_picked_updates
cherry_picked_updates
April 17, 2024 17:38 12m 3s
Cherry picked updates Pytest #102: Pull request #219 opened by ralf-meyer
April 17, 2024 16:57 12m 5s cherry_picked_updates
cherry_picked_updates
April 17, 2024 16:57 12m 5s
Merge pull request #208 from hjkgrp/active_learning Pytest #101: Commit 78edc26 pushed by ralf-meyer
April 17, 2024 12:27 12m 34s master
master
April 17, 2024 12:27 12m 34s
Classifying geometry based on RMSD Pytest #100: Pull request #213 synchronize by aarongarrison
April 16, 2024 21:07 12m 28s geometry_changes
geometry_changes
April 16, 2024 21:07 12m 28s
Delete molscontrol from the repository Pytest #99: Pull request #218 opened by ralf-meyer
April 16, 2024 18:41 12m 0s delete_molscontrol
delete_molscontrol
April 16, 2024 18:41 12m 0s
Merge pull request #215 from hjkgrp/rgen_fixes Pytest #98: Commit 7d32159 pushed by ralf-meyer
April 16, 2024 17:14 12m 31s master
master
April 16, 2024 17:14 12m 31s
Rgen fixes Pytest #97: Pull request #215 opened by ralf-meyer
April 16, 2024 12:04 12m 32s rgen_fixes
rgen_fixes
April 16, 2024 12:04 12m 32s
small change to a comment Pytest #96: Commit 50ef946 pushed by gianmarco-terrones
April 12, 2024 15:59 12m 32s master
master
April 12, 2024 15:59 12m 32s
Merge pull request #214 from hjkgrp/mol2D Pytest #95: Commit 1181ebc pushed by ralf-meyer
April 10, 2024 21:26 12m 59s master
master
April 10, 2024 21:26 12m 59s
Graph based RACs for Mol2D Pytest #94: Pull request #214 opened by ralf-meyer
April 10, 2024 21:04 12m 25s mol2D
mol2D
April 10, 2024 21:04 12m 25s
Classifying geometry based on RMSD Pytest #93: Pull request #213 synchronize by pre-commit-ci bot
April 9, 2024 20:23 12m 19s geometry_changes
geometry_changes
April 9, 2024 20:23 12m 19s
Classifying geometry based on RMSD Pytest #92: Pull request #213 opened by aarongarrison
April 9, 2024 20:23 12m 23s geometry_changes
geometry_changes
April 9, 2024 20:23 12m 23s
Merge pull request #212 from hjkgrp/fix_CI Pytest #91: Commit c606d39 pushed by ralf-meyer
April 3, 2024 12:25 12m 19s master
master
April 3, 2024 12:25 12m 19s
Fixes the recently broken CI Pytest #90: Pull request #212 opened by ralf-meyer
April 2, 2024 16:56 12m 9s fix_CI
fix_CI
April 2, 2024 16:56 12m 9s
clarifying comments to RAC generation code Pytest #89: Commit aca7fdd pushed by gianmarco-terrones
March 31, 2024 23:57 5m 6s master
master
March 31, 2024 23:57 5m 6s
more minor changes to globalvars.py Pytest #88: Commit a16d424 pushed by gianmarco-terrones
March 31, 2024 16:28 4m 56s master
master
March 31, 2024 16:28 4m 56s