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value: "Person" } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 15 name_id: 29 } } } rows { name { value: "0000-0003-0513-0288" } } rows { quad { s_iri { prefix_id: 8 } p_iri { prefix_id: 15 name_id: 28 } o_literal { lex: "https://orcid.org/0000-0003-0513-0288" } } } rows { quad { p_iri { name_id: 13 } o_literal { lex: "Gen\303\255s Bayarri" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 15 name_id: 29 } } } rows { prefix { value: "https://ror.org/https://www.python.org/" } } rows { quad { s_iri { prefix_id: 9 name_id: 2 } p_iri { prefix_id: 15 name_id: 28 } o_literal { lex: "https://www.python.org/" } } } rows { quad { p_iri { name_id: 13 } o_literal { lex: "Python" } } } rows { quad { p_iri { } o_literal { lex: "https://www.python.org/" } } } rows { name { value: "ComputerLanguage" } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 15 name_id: 31 } } } rows { prefix { value: 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datatype: 1 } } } rows { name { value: "contentUrl" } } rows { quad { p_iri { } o_literal { lex: "https://api.rohub.org/api/ros/99f82558-26e6-4c3b-9282-e50d172dee93/crate/download/" } } } rows { name { value: "creativeWorkStatus" } } rows { quad { p_iri { } o_literal { lex: "Stable" } } } rows { name { value: "creator" } } rows { quad { p_iri { } o_iri { prefix_id: 5 name_id: 25 } } } rows { name { value: "dateCreated" } } rows { quad { p_iri { prefix_id: 15 name_id: 39 } o_literal { lex: "2023-09-08 12:09:35.881875+00:00" } } } rows { name { value: "dateModified" } } rows { quad { p_iri { } o_literal { lex: "2024-03-05 12:23:16.491387+00:00" } } } rows { name { value: "datePublished" } } rows { quad { p_iri { } o_literal { lex: "2023-09-08 12:09:35.881875+00:00" } } } rows { name { value: "description" } } rows { quad { p_iri { } o_literal { lex: "# Macromolecular Coarse-Grained Flexibility (FlexServ) tutorial using BioExcel Building Blocks (biobb)\r\n\r\nThis tutorial aims to illustrate the process of generating protein conformational ensembles from 3D structures and analysing its molecular flexibility, step by step, using the BioExcel Building Blocks library (biobb).\r\n\r\n***\r\n\r\n## Copyright & Licensing\r\nThis software has been developed in the [MMB group](http://mmb.irbbarcelona.org) at the [BSC](http://www.bsc.es/) & [IRB](https://www.irbbarcelona.org/) for the [European BioExcel](http://bioexcel.eu/), funded by the European Commission (EU H2020 [823830](http://cordis.europa.eu/projects/823830), EU H2020 [675728](http://cordis.europa.eu/projects/675728)).\r\n\r\n* (c) 2015-2023 [Barcelona Supercomputing Center](https://www.bsc.es/)\r\n* (c) 2015-2023 [Institute for Research in Biomedicine](https://www.irbbarcelona.org/)\r\n\r\nLicensed under the\r\n[Apache License 2.0](https://www.apache.org/licenses/LICENSE-2.0), see the file LICENSE for details.\r\n\r\n![](https://bioexcel.eu/wp-content/uploads/2019/04/Bioexcell_logo_1080px_transp.png \"Bioexcel\")" } } } rows { name { value: "encodingFormat" } } rows { quad { p_iri { } o_literal { lex: "application/ld+json" } } } rows { name { value: "hasPart" } } rows { prefix { value: "https://w3id.org/ro-id/99f82558-26e6-4c3b-9282-e50d172dee93/resources/" } } rows { name { value: "337344fa-0758-4a52-a42e-a6dc2d8aaef6" } } rows { quad { p_iri { } o_iri { prefix_id: 13 } } } rows { name { value: "4e5a4359-d246-4e33-938a-40940b1fe9aa" } } rows { quad { o_iri { } } } rows { name { value: "55bac860-2dcf-40ca-ad43-13817dba59e1" } } rows { quad { o_iri { } } } rows { name { value: "7fb76359-0a0f-4ac0-8972-1f71d0472542" } } rows { quad { o_iri { } } } rows { name { value: "8487127e-6d71-43b9-863b-3180be9ae78a" } } rows { quad { o_iri { } } } rows { name { value: "9138e0f5-2716-48d2-8aba-cf24ae14b1b7" } } rows { quad { o_iri { } } } rows { name { value: "f02fc4ee-c9e8-45f0-a5f5-101033132c59" } } rows { quad { o_iri { } } } rows { quad { p_iri { prefix_id: 15 name_id: 28 } o_literal { lex: "https://w3id.org/ro-id/99f82558-26e6-4c3b-9282-e50d172dee93" } } } rows { name { value: "isBasedOn" } } rows { quad { p_iri { name_id: 52 } o_literal { lex: "https://github.com/bioexcel/biobb_workflows/blob/master/biobb_wf_flexserv/python" } } } rows { name { value: "license" } } rows { prefix { id: 1 value: "https://choosealicense.com/no-permission/" } } rows { quad { p_iri { } o_iri { prefix_id: 1 name_id: 2 } } } rows { name { value: "mainEntity" } } rows { quad { p_iri { prefix_id: 15 name_id: 54 } o_literal { lex: "workflow.py" } } } rows { quad { p_iri { name_id: 13 } o_literal { lex: "Research Object Crate for Python Macromolecular Coarse-Grained Flexibility tutorial" } } } rows { quad { p_iri { } o_literal { lex: "https://workflowhub.eu/workflows/553/ro_crate?version=1" } } } rows { prefix { id: 3 value: "http://purl.org/wf4ever/ro#" } } rows { name { value: "ResearchObject" } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 3 name_id: 55 } } } rows { prefix { id: 14 value: "http://purl.org/wf4ever/roevo#" } } rows { name { value: "LiveRO" } } rows { quad { o_iri { prefix_id: 14 } } } rows { name { value: "Dataset" } } rows { quad { o_iri { prefix_id: 15 } } } rows { prefix { id: 2 value: "https://www.w3.org/ns/iana/link-relations/relation#" } } rows { name { value: "cite-as" } } rows { quad { p_iri { prefix_id: 2 } o_literal { lex: "Adam Hospital, and Gen\303\255s Bayarri. \"Research Object Crate for Python Macromolecular Coarse-Grained Flexibility tutorial.\" ROHub. Sep 08 ,2023. https://w3id.org/ro-id/99f82558-26e6-4c3b-9282-e50d172dee93." } } } rows { quad { s_iri { prefix_id: 13 name_id: 45 } p_iri { prefix_id: 15 name_id: 34 } o_iri { prefix_id: 5 name_id: 25 } } } rows { quad { p_iri { prefix_id: 15 name_id: 35 } o_literal { lex: "3067" datatype: 1 } } } rows { quad { p_iri { } o_literal { lex: "https://api.rohub.org/api/resources/337344fa-0758-4a52-a42e-a6dc2d8aaef6/download/" } } } rows { quad { p_iri { name_id: 38 } o_iri { prefix_id: 5 name_id: 25 } } } rows { quad { p_iri { prefix_id: 15 name_id: 39 } o_literal { lex: "2023-09-08 12:09:36.622930+00:00" } } } rows { quad { p_iri { } o_literal { lex: "2023-09-08 12:09:37.905815+00:00" } } } rows { quad { p_iri { name_id: 43 } o_literal { lex: "text/markdown" } } } rows { quad { p_iri { name_id: 53 } o_iri { prefix_id: 1 name_id: 2 } } } rows { quad { p_iri { prefix_id: 15 name_id: 13 } o_literal { lex: "README.md" } } } rows { name { value: "sdDatePublished" } } rows { quad { p_iri { name_id: 59 } o_literal { lex: "2023-09-08 12:09:36.622930+00:00" } } } rows { prefix { id: 16 value: "http://purl.org/wf4ever/wf4ever#" } } rows { name { value: "Resource" } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 16 name_id: 60 } } } rows { quad { o_iri { prefix_id: 15 name_id: 20 } } } rows { prefix { id: 4 value: "http://purl.org/dc/terms/" } } rows { name { value: "conformsTo" } } rows { quad { s_iri { prefix_id: 13 name_id: 46 } p_iri { prefix_id: 4 name_id: 61 } o_literal { lex: "https://bioschemas.org/profiles/ComputationalWorkflow/1.0-RELEASE/" } } } rows { prefix { id: 9 value: "https://workflowhub.eu/people/" } } rows { name { value: "47" } } rows { quad { p_iri { prefix_id: 15 name_id: 34 } o_iri { prefix_id: 9 name_id: 62 } } } rows { quad { p_iri { prefix_id: 15 name_id: 35 } o_literal { lex: "7454" } } } rows { quad { p_iri { } o_literal { lex: "https://api.rohub.org/api/resources/4e5a4359-d246-4e33-938a-40940b1fe9aa/download/" } } } rows { quad { p_iri { name_id: 38 } o_iri { prefix_id: 9 name_id: 62 } } } rows { quad { p_iri { prefix_id: 15 name_id: 39 } o_literal { lex: "2023-08-02 11:23:28+00:00" } } } rows { quad { p_iri { } o_literal { lex: "2023-09-08 12:09:41.924098+00:00" } } } rows { quad { p_iri { name_id: 42 } o_literal { lex: "# Macromolecular Coarse-Grained Flexibility (FlexServ) tutorial using BioExcel Building Blocks (biobb)\r\n\r\nThis tutorial aims to illustrate the process of generating protein conformational ensembles from 3D structures and analysing its molecular flexibility, step by step, using the BioExcel Building Blocks library (biobb).\r\n\r\n***\r\n\r\n## Copyright & Licensing\r\nThis software has been developed in the [MMB group](http://mmb.irbbarcelona.org) at the [BSC](http://www.bsc.es/) & [IRB](https://www.irbbarcelona.org/) for the [European BioExcel](http://bioexcel.eu/), funded by the European Commission (EU H2020 [823830](http://cordis.europa.eu/projects/823830), EU H2020 [675728](http://cordis.europa.eu/projects/675728)).\r\n\r\n* (c) 2015-2023 [Barcelona Supercomputing Center](https://www.bsc.es/)\r\n* (c) 2015-2023 [Institute for Research in Biomedicine](https://www.irbbarcelona.org/)\r\n\r\nLicensed under the\r\n[Apache License 2.0](https://www.apache.org/licenses/LICENSE-2.0), see the file LICENSE for details.\r\n\r\n![](https://bioexcel.eu/wp-content/uploads/2019/04/Bioexcell_logo_1080px_transp.png \"Bioexcel\")" } } } rows { quad { p_iri { } o_literal { lex: "text/x-python" } } } rows { quad { p_iri { name_id: 53 } o_iri { prefix_id: 1 name_id: 2 } } } rows { quad { p_iri { prefix_id: 15 name_id: 13 } o_literal { lex: "Python Macromolecular Coarse-Grained Flexibility tutorial" } } } rows { name { value: "producer" } } rows { quad { p_iri { name_id: 63 } o_literal { lex: "https://workflowhub.eu/projects/11" } } } rows { name { value: "programmingLanguage" } } rows { quad { p_iri { } o_literal { lex: "#python" } } } rows { quad { p_iri { name_id: 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{ prefix_id: 16 name_id: 60 } } } rows { quad { o_iri { prefix_id: 15 name_id: 20 } } } rows { quad { s_iri { prefix_id: 13 name_id: 49 } p_iri { prefix_id: 15 name_id: 34 } o_iri { prefix_id: 5 name_id: 25 } } } rows { quad { p_iri { prefix_id: 15 name_id: 35 } o_literal { lex: "57996" datatype: 1 } } } rows { quad { p_iri { } o_literal { lex: "https://api.rohub.org/api/resources/8487127e-6d71-43b9-863b-3180be9ae78a/download/" } } } rows { quad { p_iri { name_id: 38 } o_iri { prefix_id: 5 name_id: 25 } } } rows { quad { p_iri { prefix_id: 15 name_id: 39 } o_literal { lex: "2023-09-08 12:09:36.624293+00:00" } } } rows { quad { p_iri { } o_literal { lex: "2023-09-08 12:09:38.114321+00:00" } } } rows { quad { p_iri { name_id: 43 } o_literal { lex: "chemical/x-pdb" } } } rows { quad { p_iri { name_id: 53 } o_iri { prefix_id: 1 name_id: 2 } } } rows { quad { p_iri { prefix_id: 15 name_id: 13 } o_literal { lex: "structure.pdb" } } } rows { quad { p_iri { name_id: 59 } o_literal { lex: "2023-09-08 12:09:36.624293+00:00" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 16 name_id: 60 } } } rows { quad { o_iri { prefix_id: 15 name_id: 20 } } } rows { quad { s_iri { prefix_id: 13 name_id: 50 } p_iri { prefix_id: 15 name_id: 34 } o_iri { prefix_id: 5 name_id: 25 } } } rows { quad { p_iri { prefix_id: 15 name_id: 35 } o_literal { lex: "412736" datatype: 1 } } } rows { quad { p_iri { } o_literal { lex: "https://api.rohub.org/api/resources/9138e0f5-2716-48d2-8aba-cf24ae14b1b7/download/" } } } rows { quad { p_iri { name_id: 38 } o_iri { prefix_id: 5 name_id: 25 } } } rows { quad { p_iri { prefix_id: 15 name_id: 39 } o_literal { lex: "2023-09-08 12:09:36.621805+00:00" } } } rows { quad { p_iri { } o_literal { lex: "2023-09-08 12:09:37.457685+00:00" } } } rows { quad { p_iri { name_id: 53 } o_iri { prefix_id: 1 name_id: 2 } } } rows { quad { p_iri { prefix_id: 15 name_id: 13 } o_literal { lex: "1a32.MoDEL.pcz" } } } rows { quad { p_iri { name_id: 59 } o_literal { lex: "2023-09-08 12:09:36.621805+00:00" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 16 name_id: 60 } } } rows { quad { o_iri { prefix_id: 15 name_id: 20 } } } rows { quad { s_iri { prefix_id: 13 name_id: 51 } p_iri { prefix_id: 15 name_id: 34 } o_iri { prefix_id: 5 name_id: 25 } } } rows { quad { p_iri { prefix_id: 15 name_id: 35 } o_literal { lex: "7748" datatype: 1 } } } rows { quad { p_iri { } o_literal { lex: "https://api.rohub.org/api/resources/f02fc4ee-c9e8-45f0-a5f5-101033132c59/download/" } } } rows { quad { p_iri { name_id: 38 } o_iri { prefix_id: 5 name_id: 25 } } } rows { quad { p_iri { prefix_id: 15 name_id: 39 } o_literal { lex: "2023-09-08 12:09:36.627294+00:00" } } } rows { quad { p_iri { } o_literal { lex: "2023-09-08 12:09:39.200763+00:00" } } } rows { quad { p_iri { name_id: 53 } o_iri { prefix_id: 1 name_id: 2 } } } rows { quad { p_iri { prefix_id: 15 name_id: 13 } o_literal { lex: "workflow.yml" } } } rows { quad { p_iri { name_id: 59 } o_literal { lex: "2023-09-08 12:09:36.627294+00:00" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 16 name_id: 60 } } } rows { quad { o_iri { prefix_id: 15 name_id: 20 } } } rows { name { value: "ro-crate-metadata.json" } } rows { prefix { id: 7 value: "https://w3id.org/ro/crate/" } } rows { name { value: "1.1" } } rows { quad { s_iri { prefix_id: 11 name_id: 69 } p_iri { prefix_id: 4 name_id: 61 } o_iri { prefix_id: 7 name_id: 70 } } } rows { quad { p_iri { prefix_id: 15 name_id: 68 } o_iri { prefix_id: 11 name_id: 2 } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 15 name_id: 18 } } } rows { quad { s_iri { prefix_id: 9 name_id: 62 } p_iri { prefix_id: 15 name_id: 13 } o_literal { lex: "Gen\303\255s Bayarri" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 15 name_id: 29 } } } rows { name { value: "57" } } rows { quad { s_iri { prefix_id: 9 name_id: 71 } p_iri { prefix_id: 15 name_id: 13 } o_literal { lex: "Adam Hospital" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 15 name_id: 29 } } } rows { prefix { id: 12 value: "https://workflowhub.eu/projects/" } } rows { name { value: "11" } } rows { quad { s_iri { prefix_id: 12 name_id: 72 } p_iri { prefix_id: 15 name_id: 13 } o_literal { lex: "BioBB Building Blocks" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 15 name_id: 15 } } } rows { name { value: "Project" } } rows { quad { o_iri { name_id: 73 } } } rows { prefix { id: 8 value: "https://w3id.org/np/RA9ki5RxmdYDNpVJWyvhPorAz4HEY_3Mk-hlfI7gF8rFY/" } } rows { prefix { id: 3 value: "http://www.w3.org/ns/prov#" } } rows { name { value: "wasDerivedFrom" } } rows { prefix { id: 14 value: "https://api.rohub.org/api/ros/99f82558-26e6-4c3b-9282-e50d172dee93/crate/download/" } } rows { quad { s_iri { prefix_id: 8 name_id: 4 } p_iri { prefix_id: 3 name_id: 74 } o_iri { prefix_id: 14 name_id: 69 } g_iri { prefix_id: 8 name_id: 7 } } } rows { prefix { id: 2 value: "https://w3id.org/np/" } } rows { name { value: "created" } } rows { datatype { value: "http://www.w3.org/2001/XMLSchema#dateTime" } } rows { quad { s_iri { prefix_id: 2 name_id: 1 } p_iri { prefix_id: 4 name_id: 75 } o_literal { lex: "2025-11-11T16:09:14.386+01:00" datatype: 2 } g_iri { prefix_id: 8 name_id: 9 } } } rows { prefix { id: 10 value: "http://purl.org/nanopub/x/" } } rows { name { value: "introduces" } } rows { quad { p_iri { prefix_id: 10 name_id: 76 } o_iri { prefix_id: 11 name_id: 2 } } } rows { name { value: "RoCrateNanopub" } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 10 name_id: 77 } } } rows { prefix { id: 13 value: "http://www.w3.org/2000/01/rdf-schema#" } } rows { name { value: "label" } } rows { quad { p_iri { prefix_id: 13 } o_literal { lex: "Research Object Crate for Python Macromolecular Coarse-Grained Flexibility tutorial" } } } rows { name { value: "sig" } } rows { name { value: "hasAlgorithm" } } rows { quad { s_iri { prefix_id: 8 } p_iri { prefix_id: 10 } o_literal { lex: "RSA" } } } rows { name { value: "hasPublicKey" } } rows { quad { p_iri { } o_literal { lex: "MIIBIjANBgkqhkiG9w0BAQEFAAOCAQ8AMIIBCgKCAQEA4pPaESKwmC6l37P86K6TNLq6yeQtc7m9CvcqauLs/1FC0viHvQnFBgxj0a+loPDv/Egwe6OqFpa0iW9Ypnyz9YPoh+pxbRXonbuMOb+8Ry9hXZ+TEKfWjhjVDGEaClwfRwglh2HI/xfV4CD9AgvDOEoZQiyta8a90PYwJ3G6e70oCHTn61+OWTkI9KRYHOYgg3btdy2Z7q/30PTFawb2ZT5aIfIJYobUYv2a7yhtcqWCHZeKv0bxGnRjTFNx1rscBMlLJSzvRtpQc1cCRVEPFZHo1adaXCI9tGvn4cxeNQ96y8dxkN1XhpaJairde+23MDzf42Oe97KG2HYzKiyVnQIDAQAB" } } } rows { name { value: "hasSignature" } } rows { quad { p_iri { } o_literal { lex: "x72Y1BneDEq05hA1Qw8fAvXLq5R2Y49UMY1/brOV4jo92/5pmdgh8/J+Xq532io8Ft7BfeOw4eTYmW6A8dU7Vku2TfaM3+5WyL90tEMfnhEab0hQgd2F00omaTiIB8pF2Y7jZqPTlnFL27QBYz7bEvwcooAEwquDUmivRfLehnY8fAJe6Es6Pcs3KCxrCioGpZEVXZYml7++0NBjYyfjAFAoycKzaBam4Y8O8z3DEgbL86mz2u4viv8PNScdkPB/mny9c0jKqYiAMwHP/xuRX0FsFtIrVXI6XobughyNqUSzPzde+cuQUGv7qi+DK3pEHa/p/RfuY0WZJA2eA5rG2Q==" } } } rows { name { value: "hasSignatureTarget" } } rows { quad { p_iri { } o_iri { prefix_id: 2 name_id: 1 } } } rows { name { value: "signedBy" } } rows { prefix { id: 5 value: "https://w3id.org/kpxl/gen/terms/" } } rows { name { value: "RoCrateBot" } } rows { quad { p_iri { prefix_id: 10 name_id: 84 } o_iri { prefix_id: 5 } } }