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"selector": "ligand" }, "children": [ { "kind": "focus" }, { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "magenta" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'...'magenta'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ions-1cbs", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 0.8889, "f1_std": 0.0, "f1_min": 0.8889, "f1_max": 0.8889, "precision": 0.8889, "recall": 0.8889, "n_samples": 3, "samples_f1": [ 0.8889, 0.8889, 0.8889 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/1cbs.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "protein" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ion" }, "children": [ { "kind": "representation", "params": { "type": "spacefill" }, "children": [ { "kind": "color", "params": { "color": "purple" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'purple'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ions-1hho", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 1.0, "f1_std": 0.0, "f1_min": 1.0, "f1_max": 1.0, "precision": 1.0, "recall": 1.0, "n_samples": 3, "samples_f1": [ 1.0, 1.0, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/1HHO.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ion" }, "children": [ { "kind": "representation", "params": { "type": "spacefill" }, "children": [ { "kind": "color", "params": { "color": "purple" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'purple'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ions-1lyz", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 0.963, "f1_std": 0.0524, "f1_min": 0.8889, "f1_max": 1.0, "precision": 0.963, "recall": 0.963, "n_samples": 3, "samples_f1": [ 1.0, 1.0, 0.8889 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/1lyz.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ion" }, "children": [ { "kind": "representation", "params": { "type": "spacefill" }, "children": [ { "kind": "color", "params": { "color": "purple" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'purple'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ions-2hhb", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 0.963, "f1_std": 0.0524, "f1_min": 0.8889, "f1_max": 1.0, "precision": 0.963, "recall": 0.963, "n_samples": 3, "samples_f1": [ 1.0, 0.8889, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/2HHB.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ion" }, "children": [ { "kind": "representation", "params": { "type": "spacefill" }, "children": [ { "kind": "color", "params": { "color": "purple" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'purple'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ions-3ptb", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 0.9259, "f1_std": 0.0524, "f1_min": 0.8889, "f1_max": 1.0, "precision": 0.9259, "recall": 0.9259, "n_samples": 3, "samples_f1": [ 0.8889, 0.8889, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/3PTB.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ion" }, "children": [ { "kind": "representation", "params": { "type": "spacefill" }, "children": [ { "kind": "color", "params": { "color": "purple" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'purple'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ions-4ins", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 1.0, "f1_std": 0.0, "f1_min": 1.0, "f1_max": 1.0, "precision": 1.0, "recall": 1.0, "n_samples": 3, "samples_f1": [ 1.0, 1.0, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/4INS.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ion" }, "children": [ { "kind": "representation", "params": { "type": "spacefill" }, "children": [ { "kind": "color", "params": { "color": "purple" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'purple'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ligands-1cbs", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 1.0, "f1_std": 0.0, "f1_min": 1.0, "f1_max": 1.0, "precision": 1.0, "recall": 1.0, "n_samples": 3, "samples_f1": [ 1.0, 1.0, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/1CBS.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ligand" }, "children": [ { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "purple" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'purple'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ligands-1hho", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 1.0, "f1_std": 0.0, "f1_min": 1.0, "f1_max": 1.0, "precision": 1.0, "recall": 1.0, "n_samples": 3, "samples_f1": [ 1.0, 1.0, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/1HHO.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ligand" }, "children": [ { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "red" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'...r': 'red'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ligands-1lyz", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 0.9259, "f1_std": 0.0524, "f1_min": 0.8889, "f1_max": 1.0, "precision": 0.9259, "recall": 0.9259, "n_samples": 3, "samples_f1": [ 0.8889, 1.0, 0.8889 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/1lyz.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ligand" }, "children": [ { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "green" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'...: 'green'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ligands-2hhb", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 1.0, "f1_std": 0.0, "f1_min": 1.0, "f1_max": 1.0, "precision": 1.0, "recall": 1.0, "n_samples": 3, "samples_f1": [ 1.0, 1.0, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/2HHB.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "grey" } } ] } ] }, { "kind": "component", "params": { "selector": "ligand" }, "children": [ { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "teal" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'...': 'teal'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ligands-3ptb", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 0.8889, "f1_std": 0.0, "f1_min": 0.8889, "f1_max": 0.8889, "precision": 0.8889, "recall": 0.8889, "n_samples": 3, "samples_f1": [ 0.8889, 0.8889, 0.8889 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/3ptb.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "protein" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ligand" }, "children": [ { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "orange" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'orange'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-ligands-4ins", "category": "mvs", "categories": [ "load", "representation", "color", "multi-component" ], "f1": 0.9259, "f1_std": 0.0524, "f1_min": 0.8889, "f1_max": 1.0, "precision": 0.9259, "recall": 0.9259, "n_samples": 3, "samples_f1": [ 0.8889, 0.8889, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/4INS.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": "ligand" }, "children": [ { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "blue" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'...': 'blue'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-range-1cbs", "category": "mvs", "categories": [ "load", "selection", "representation", "color", "multi-component" ], "f1": 1.0, "f1_std": 0.0, "f1_min": 1.0, "f1_max": 1.0, "precision": 1.0, "recall": 1.0, "n_samples": 3, "samples_f1": [ 1.0, 1.0, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/1CBS.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": { "auth_asym_id": "A", "beg_auth_seq_id": 20, "end_auth_seq_id": 60 } }, "children": [ { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "orange" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 'orange'}}]}]}]}]}]}]}}, input_type=dict]\n For further information visit https://errors.pydantic.dev/2.13/v/json_type" ] }, { "id": "gen-range-1hho", "category": "mvs", "categories": [ "load", "selection", "representation", "color", "multi-component" ], "f1": 1.0, "f1_std": 0.0, "f1_min": 1.0, "f1_max": 1.0, "precision": 1.0, "recall": 1.0, "n_samples": 3, "samples_f1": [ 1.0, 1.0, 1.0 ], "predicted": { "root": { "kind": "root", "children": [ { "kind": "download", "params": { "url": "https://files.rcsb.org/download/1HHO.cif" }, "children": [ { "kind": "parse", "params": { "format": "mmcif" }, "children": [ { "kind": "structure", "params": { "type": "model" }, "children": [ { "kind": "component", "params": { "selector": "polymer" }, "children": [ { "kind": "representation", "params": { "type": "cartoon" }, "children": [ { "kind": "color", "params": { "color": "gray" } } ] } ] }, { "kind": "component", "params": { "selector": { "auth_asym_id": "A", "beg_auth_seq_id": 30, "end_auth_seq_id": 90 } }, "children": [ { "kind": "representation", "params": { "type": "ball_and_stick" }, "children": [ { "kind": "color", "params": { "color": "orange" } } ] } ] } ] } ] } ] } ] } }, "error": null, "schema_errors": [ "MVS validation: 1 validation error for State\n JSON input should be string, bytes or bytearray [type=json_type, input_value={'kind': 'single', 'root'... 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