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Add test_refmoleclist.ipynb
Python Package using Conda #343: Commit e5bafa2 pushed by choglass
February 29, 2024 00:40 2m 45s dev_update
February 29, 2024 00:40 2m 45s
Debugging and get_reference_molecules
Python Package using Conda #342: Commit baf947d pushed by choglass
February 29, 2024 00:38 2m 39s dev_update
February 29, 2024 00:38 2m 39s
debugging
Python Package using Conda #341: Commit a37c75a pushed by svela-bs
February 28, 2024 11:59 2m 35s dev_update
February 28, 2024 11:59 2m 35s
Debugging
Python Package using Conda #340: Commit 678191f pushed by choglass
February 27, 2024 15:16 2m 37s dev_update
February 27, 2024 15:16 2m 37s
removed build_bonds
Python Package using Conda #339: Commit 3f61308 pushed by svela-bs
February 27, 2024 12:22 2m 29s dev_update
February 27, 2024 12:22 2m 29s
finished prepare_mols, small fixes
Python Package using Conda #338: Commit 127f67a pushed by svela-bs
February 27, 2024 12:20 2m 37s dev_update
February 27, 2024 12:20 2m 37s
Update in prepare_mols
Python Package using Conda #337: Commit b46921d pushed by choglass
February 26, 2024 11:13 2m 41s dev_update
February 26, 2024 11:13 2m 41s
Debugging
Python Package using Conda #336: Commit 5b9338e pushed by choglass
February 23, 2024 21:33 2m 28s dev_update
February 23, 2024 21:33 2m 28s
Prefilter .cif file
Python Package using Conda #335: Commit 8a44056 pushed by choglass
February 23, 2024 19:52 2m 32s dev_update
February 23, 2024 19:52 2m 32s
changes before prepare_mols
Python Package using Conda #334: Commit 3161d47 pushed by svela-bs
February 23, 2024 16:55 2m 33s dev_update
February 23, 2024 16:55 2m 33s
Day5 Feb-23-2024
Python Package using Conda #333: Commit 6e67267 pushed by choglass
February 23, 2024 15:24 2m 33s dev_update
February 23, 2024 15:24 2m 33s
Day4 Feb-22-2024
Python Package using Conda #332: Commit cc79019 pushed by choglass
February 22, 2024 16:41 2m 35s dev_update
February 22, 2024 16:41 2m 35s
Day3 Feb-21-2024
Python Package using Conda #331: Commit d3f8d3e pushed by choglass
February 21, 2024 16:24 2m 40s dev_update
February 21, 2024 16:24 2m 40s
Add test/MUKJOS.cif
Python Package using Conda #330: Commit 85e44e3 pushed by choglass
February 21, 2024 16:24 2m 38s dev_update
February 21, 2024 16:24 2m 38s
BACZUB and INOVAL for testing
Python Package using Conda #329: Commit 12e3822 pushed by choglass
February 20, 2024 18:19 2m 36s dev_update
February 20, 2024 18:19 2m 36s
BACZUB and INOVAL for testing
Python Package using Conda #328: Commit 8b2305c pushed by choglass
February 20, 2024 18:18 2m 33s dev_update
February 20, 2024 18:18 2m 33s
BACZUB and INOVAL for testing
Python Package using Conda #327: Commit c91a9ed pushed by choglass
February 20, 2024 17:49 2m 46s dev_update
February 20, 2024 17:49 2m 46s
Day 2 Feb-10-2024
Python Package using Conda #326: Commit 584a32e pushed by choglass
February 20, 2024 17:47 2m 40s dev_update
February 20, 2024 17:47 2m 40s
Day 1 Feb-19-2024
Python Package using Conda #325: Commit 83cb4fa pushed by choglass
February 19, 2024 16:59 2m 36s dev_update
February 19, 2024 16:59 2m 36s
initial files
Python Package using Conda #324: Commit 8280961 pushed by svela-bs
February 19, 2024 09:21 5m 10s dev_update
February 19, 2024 09:21 5m 10s
Update environment.yml
Python Package using Conda #323: Commit 9dd87ee pushed by choglass
February 19, 2024 09:14 5m 17s dev_update
February 19, 2024 09:14 5m 17s
Update environment.yml
Python Package using Conda #322: Commit 9dd87ee pushed by choglass
January 9, 2024 14:29 5m 23s dev
dev
January 9, 2024 14:29 5m 23s
Update python-package-conda.yml
Python Package using Conda #321: Commit 2389664 pushed by choglass
January 9, 2024 14:29 1m 57s dev
dev
January 9, 2024 14:29 1m 57s
Add libmambapy 1.5.3 environment.yml
Python Package using Conda #320: Commit 4e9c064 pushed by choglass
January 9, 2024 14:20 3m 23s dev
dev
January 9, 2024 14:20 3m 23s
conda install -n base conda-libmamba-solver
Python Package using Conda #319: Commit 220599f pushed by choglass
January 9, 2024 14:13 2m 20s dev
dev
January 9, 2024 14:13 2m 20s