| { |
| "format": "oscr-script-manifest/1", |
| "repository": "zenodo:10566716", |
| "url": "https://zenodo.org/records/10566716", |
| "host": "zenodo.org", |
| "commit": "", |
| "license": "MIT", |
| "license_confirmed_by": "license file LICENSE", |
| "redistribution": "yes", |
| "files": [ |
| { |
| "path": "LICENSE", |
| "sha256": "981e79a12f74c821c3b7798b1784faf434d55d6c25221626cceb5d506faa8e88", |
| "language": "License", |
| "lines": 21, |
| "truncated": false, |
| "block": 9, |
| "row": 2824 |
| }, |
| { |
| "path": "README.md", |
| "sha256": "a7373012c98b3f4960eb4f6a56310d5f5b337059aa7d22d77d0ba197766f23d0", |
| "language": "Text", |
| "lines": 119, |
| "truncated": false, |
| "block": 9, |
| "row": 14627 |
| }, |
| { |
| "path": "docs/conf.py", |
| "sha256": "616e099522a57b01b306bcc9588a9cfacb58ec9da75f42a2de8707ace4300826", |
| "language": "Python", |
| "lines": 80, |
| "truncated": false, |
| "block": 9, |
| "row": 8353 |
| }, |
| { |
| "path": "examples/kartograf_example.ipynb", |
| "sha256": "0438874f8cbe648f2dffc7ee0e82a32fb1a79d4774e1d052e41542ffe685ec4c", |
| "language": "Jupyter", |
| "lines": 143, |
| "truncated": false, |
| "block": 9, |
| "row": 2335 |
| }, |
| { |
| "path": "src/kartograf/__init__.py", |
| "sha256": "44df6cada3beae15f1c15ed3246dc5f2e07396e7c573d5feda4d6925c87a3db1", |
| "language": "Python", |
| "lines": 19, |
| "truncated": false, |
| "block": 9, |
| "row": 6699 |
| }, |
| { |
| "path": "src/kartograf/atom_aligner.py", |
| "sha256": "fd78cf06e1e5ab4e13ec8ef1e56c604a1c64f910298549ca00d3ed97aca57da6", |
| "language": "Python", |
| "lines": 102, |
| "truncated": false, |
| "block": 9, |
| "row": 8193 |
| }, |
| { |
| "path": "src/kartograf/atom_mapper.py", |
| "sha256": "80849a98abc43e960accba41094e39eb4ead8abeb2c9bcc3dc26101d6f8bbb8f", |
| "language": "Python", |
| "lines": 882, |
| "truncated": false, |
| "block": 9, |
| "row": 12235 |
| }, |
| { |
| "path": "src/kartograf/atom_mapping_scorer.py", |
| "sha256": "32a409e15b36a4f794c9fe24dd718c48ef535c4b125724ea4402fb15c88e400d", |
| "language": "Python", |
| "lines": 67, |
| "truncated": false, |
| "block": 9, |
| "row": 7790 |
| }, |
| { |
| "path": "src/kartograf/filters/__init__.py", |
| "sha256": "eeaa4b7c205cbebb314617b4f50c7be3b5dc5c29ac978096e99be522ebcd54e9", |
| "language": "Python", |
| "lines": 9, |
| "truncated": false, |
| "block": 9, |
| "row": 6454 |
| }, |
| { |
| "path": "src/kartograf/filters/element_change.py", |
| "sha256": "0a0b5645b33f268c91a5d69c37963e2e470affa9e3767651e42faf2e23d0fe07", |
| "language": "Python", |
| "lines": 51, |
| "truncated": false, |
| "block": 9, |
| "row": 7600 |
| }, |
| { |
| "path": "src/kartograf/filters/ring_changes.py", |
| "sha256": "1b90ab7e96a2efc456a53962fe07952a4c6d3baacbed313446fa92daefb996e7", |
| "language": "Python", |
| "lines": 99, |
| "truncated": false, |
| "block": 9, |
| "row": 8650 |
| }, |
| { |
| "path": "src/kartograf/mapping_metrics/__init__.py", |
| "sha256": "f77dd83fe69679f990867caf8e3d501530cc2f505dd77b901ae5a69f6d0b37a2", |
| "language": "Python", |
| "lines": 12, |
| "truncated": false, |
| "block": 9, |
| "row": 6582 |
| }, |
| { |
| "path": "src/kartograf/mapping_metrics/_abstract_scorer.py", |
| "sha256": "e6a5e73c24739adfc8535899ec765c385f46e3369868bdeeff02028266d4583a", |
| "language": "Python", |
| "lines": 42, |
| "truncated": false, |
| "block": 9, |
| "row": 7210 |
| }, |
| { |
| "path": "src/kartograf/mapping_metrics/metric_mapping_rmsd.py", |
| "sha256": "e38cc7e68d53278b9023757fa840b6b9f0e366e80eb28a1d1a72ba7d351c3e96", |
| "language": "Python", |
| "lines": 104, |
| "truncated": false, |
| "block": 9, |
| "row": 8527 |
| }, |
| { |
| "path": "src/kartograf/mapping_metrics/metric_shape_difference.py", |
| "sha256": "bc56f6d5807685f2f67603b253ef925bf8b7e8020625c1f3b40e586dd81bd9d6", |
| "language": "Python", |
| "lines": 284, |
| "truncated": false, |
| "block": 9, |
| "row": 10632 |
| }, |
| { |
| "path": "src/kartograf/mapping_metrics/metric_volume_ratio.py", |
| "sha256": "64b98652f18eef60cba90b422946a2adb38b1976014d242b028ac8a116a08826", |
| "language": "Python", |
| "lines": 110, |
| "truncated": false, |
| "block": 9, |
| "row": 8792 |
| }, |
| { |
| "path": "src/kartograf/mapping_metrics/metrics_mapping_comparisons.py", |
| "sha256": "1c988644435884664f41c2eddb85ec3ea0fc4a37de5f45bd2c930fc284ebec4d", |
| "language": "Python", |
| "lines": 38, |
| "truncated": false, |
| "block": 9, |
| "row": 7367 |
| }, |
| { |
| "path": "src/kartograf/tests/__init__.py", |
| "sha256": "5cc4bde3f27ff8081249f2838803c3679a06dc0e2262e5a461838a8d84c8c7c5", |
| "language": "Python", |
| "lines": 2, |
| "truncated": false, |
| "block": 9, |
| "row": 6379 |
| }, |
| { |
| "path": "src/kartograf/tests/conftest.py", |
| "sha256": "b88dbadddcc6d0deb628825c261a03c972d9cb6bf491c4c7eda2e3322329e777", |
| "language": "Python", |
| "lines": 110, |
| "truncated": false, |
| "block": 9, |
| "row": 8312 |
| }, |
| { |
| "path": "src/kartograf/tests/test_atom_align.py", |
| "sha256": "a4b0b2c7f1858a2b3d2b65e312702f138c3a39bd9c3fed36912fc6ca7fe13e8c", |
| "language": "Python", |
| "lines": 23, |
| "truncated": false, |
| "block": 9, |
| "row": 6773 |
| }, |
| { |
| "path": "src/kartograf/tests/test_atom_mapper.py", |
| "sha256": "c7fca251b1e0a62e52509064f987771b95eac42a73101600eb325969c94bde8f", |
| "language": "Python", |
| "lines": 273, |
| "truncated": false, |
| "block": 9, |
| "row": 10523 |
| }, |
| { |
| "path": "src/kartograf/tests/test_atom_mapping_comparer.py", |
| "sha256": "0b80cc4b454004f3b6bf7af3a8e14a52f480090aa882c10480927b092c972b85", |
| "language": "Python", |
| "lines": 89, |
| "truncated": false, |
| "block": 9, |
| "row": 8702 |
| }, |
| { |
| "path": "src/kartograf/tests/test_atom_mapping_scorer.py", |
| "sha256": "67840be4a97483719eb5501e364e6a74b24c8e370c150c3723d14cebf0ce862d", |
| "language": "Python", |
| "lines": 116, |
| "truncated": false, |
| "block": 9, |
| "row": 8880 |
| }, |
| { |
| "path": "src/kartograf/tests/test_element_filters.py", |
| "sha256": "bfc3035b7df2602b095a346dba6966f8ec602c8481a2086d7929d4ed8ef69ed0", |
| "language": "Python", |
| "lines": 40, |
| "truncated": false, |
| "block": 9, |
| "row": 7276 |
| }, |
| { |
| "path": "src/kartograf/tests/test_ring_filters.py", |
| "sha256": "cce90fd1d878f491aa36c36ce5b7058caf6a96725a5ae1060a93a9af817d1d3e", |
| "language": "Python", |
| "lines": 87, |
| "truncated": false, |
| "block": 9, |
| "row": 8076 |
| }, |
| { |
| "path": "src/kartograf/tests/test_utils_vis.py", |
| "sha256": "43d6bcbf1440e1f8ac03c3beb1ac71ffe81c5c089cbda6ae126a8583a187afb2", |
| "language": "Python", |
| "lines": 32, |
| "truncated": false, |
| "block": 9, |
| "row": 6992 |
| }, |
| { |
| "path": "src/kartograf/utils/mapping_visualization_widget.py", |
| "sha256": "b929e2c3e7c174e27f01b070581eeb28975c17b8db9b9a3e43071dcb39a500e6", |
| "language": "Python", |
| "lines": 99, |
| "truncated": false, |
| "block": 9, |
| "row": 8489 |
| }, |
| { |
| "path": "src/kartograf/utils/optional_imports.py", |
| "sha256": "5c79c0590c86fe54724c3fc01ff7cb50a460afeadf7d5734ff695992ec7eec08", |
| "language": "Python", |
| "lines": 44, |
| "truncated": false, |
| "block": 9, |
| "row": 7428 |
| } |
| ] |
| } |
