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Fixed a minor bug in stitch_time_series_for_sim
lint #391: Commit b399004 pushed by wehs7661
March 28, 2024 16:17 27s add_tests
March 28, 2024 16:17 27s
March 28, 2024 10:44 21s
Added tests for traj2transmtx and plot_rep_trajs
lint #388: Commit 6d10c6d pushed by wehs7661
March 26, 2024 19:20 14s add_tests
March 26, 2024 19:20 14s
Added test_clustering.py
lint #387: Commit 60daa80 pushed by wehs7661
March 26, 2024 16:17 31s add_tests
March 26, 2024 16:17 31s
Add unit tests for utils.py and tweaked utils.py
lint #386: Commit 194235c pushed by wehs7661
March 26, 2024 11:17 15s add_tests
March 26, 2024 11:17 15s
Added a test for compare_MDPs
lint #385: Commit 7e2fb7d pushed by wehs7661
March 26, 2024 09:10 18s add_tests
March 26, 2024 09:10 18s
Modified test_run_grompp and .circleci/config.yml
lint #384: Commit 946d0c2 pushed by wehs7661
March 26, 2024 07:32 15s add_tests
March 26, 2024 07:32 15s
Fixed a bug in the unit test of test_mpi_func.py
lint #383: Commit b1876dc pushed by wehs7661
March 26, 2024 04:24 16s add_tests
March 26, 2024 04:24 16s
Modified .circleci/config.yml
lint #382: Commit d57ba99 pushed by wehs7661
March 25, 2024 19:39 14s add_tests
March 25, 2024 19:39 14s
Changed the image in config.yml for CircleCI
lint #381: Commit 80c6d57 pushed by wehs7661
March 25, 2024 18:50 21s add_tests
March 25, 2024 18:50 21s
Fixed a bug in test_mpi_func.py
lint #380: Commit 8592b3e pushed by wehs7661
March 25, 2024 18:46 21s add_tests
March 25, 2024 18:46 21s
Some minor tweaks
lint #379: Commit ab675f4 pushed by wehs7661
March 25, 2024 18:37 17s add_tests
March 25, 2024 18:37 17s
Added a unit test for _run_grompp
lint #378: Commit 2a76ea5 pushed by wehs7661
March 25, 2024 18:01 20s add_tests
March 25, 2024 18:01 20s
Minor tweaks for the working directory
lint #377: Commit 060c608 pushed by wehs7661
March 25, 2024 17:50 19s add_tests
March 25, 2024 17:50 19s
Added the YAML parameter working_dir
lint #375: Commit 4a591cb pushed by wehs7661
March 25, 2024 17:25 20s add_tests
March 25, 2024 17:25 20s
Added a test using mpi4py
lint #374: Commit fbcab8d pushed by wehs7661
March 25, 2024 15:53 15s add_tests
March 25, 2024 15:53 15s
Enhanced the code coverage of replica_exchange_EE.py
lint #373: Commit 06070b5 pushed by wehs7661
March 25, 2024 15:35 23s add_tests
March 25, 2024 15:35 23s
Enhanced the code coverage for the function set_params
lint #372: Commit 721e320 pushed by wehs7661
March 25, 2024 10:46 18s add_tests
March 25, 2024 10:46 18s
Minor tweaks
lint #371: Commit 7ebe1a5 pushed by wehs7661
March 25, 2024 08:36 16s master
March 25, 2024 08:36 16s
Merge pull request #36 from wehs7661/analysis_tweaks
lint #370: Commit 074dd47 pushed by wehs7661
February 29, 2024 12:22 21s master
February 29, 2024 12:22 21s
Fixed linting errors
lint #369: Commit 2a51ffc pushed by wehs7661
February 29, 2024 12:12 15s analysis_tweaks
February 29, 2024 12:12 15s
Modified clustering.py
lint #367: Commit 02136d6 pushed by wehs7661
February 29, 2024 10:44 19s analysis_tweaks
February 29, 2024 10:44 19s
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