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} rows { name { value: "6c9bd2a7-d6ae-417d-8725-1775ba49a710" } } rows { quad { s_iri { prefix_id: 16 name_id: 42 } p_iri { prefix_id: 15 name_id: 14 } o_literal { lex: "email" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 4 name_id: 20 } } } rows { quad { p_iri { } o_literal { lex: "17.953667953667956" } } } rows { quad { p_iri { } o_literal { lex: "9.3" } } } rows { name { value: "6d64cb6f-bba3-422a-9f22-e50cf44e5852" } } rows { quad { s_iri { prefix_id: 16 name_id: 43 } p_iri { prefix_id: 15 name_id: 14 } o_literal { lex: "electrostatics" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 4 name_id: 24 } } } rows { quad { p_iri { name_id: 21 } o_literal { lex: "3.5789473684210527" } } } rows { quad { p_iri { } o_literal { lex: "3.4" } } } rows { name { value: "73905897-de84-4a04-bcd6-a7b2ce83c88c" } } rows { quad { s_iri { prefix_id: 16 name_id: 44 } p_iri { prefix_id: 15 name_id: 14 } o_literal { lex: "As for the manuscript files, the first version is in the \"BtPIPLC_for_BPJ\". The \"BPJ_reply_for_appeal\" directory should have all the later submission files." } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 4 name_id: 30 } } } rows { quad { p_iri { name_id: 21 } o_literal { lex: "35.85313174946005" } } } rows { quad { p_iri { } o_literal { lex: "16.6" } } } rows { name { value: "7810fac8-6b5f-44a0-b287-ad1f6e5f95f4" } } rows { quad { s_iri { prefix_id: 16 name_id: 45 } p_iri { prefix_id: 15 name_id: 14 } o_literal { lex: "simulation" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 4 name_id: 24 } } } rows { quad { p_iri { name_id: 21 } o_literal { lex: "7.157894736842105" } } } rows { quad { p_iri { } o_literal { lex: "6.8" } } } rows { name { value: "83e5584e-d7cf-4d02-99a2-5962c272f8fe" } } rows { quad { s_iri { prefix_id: 16 name_id: 46 } p_iri { prefix_id: 15 name_id: 14 } o_literal { lex: "computer operations and hardware" } } } rows { name { value: "NASA" } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 4 name_id: 47 } } } rows { quad { p_iri { name_id: 21 } o_literal { lex: "100.0" } } } rows { quad { p_iri { } o_literal { lex: "0.8506443500518799" } } } rows { name { value: "854cc217-719b-41cb-9ed7-619a62f6711a" } } rows { quad { s_iri { prefix_id: 16 name_id: 48 } p_iri { prefix_id: 15 name_id: 14 } o_literal { lex: "calculation" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 4 name_id: 24 } } } rows { quad { p_iri { name_id: 21 } o_literal { lex: "7.684210526315789" } } } rows { quad { p_iri { } o_literal { lex: "7.3" } } } rows { prefix { value: "https://w3id.org/ro-id/8c5d4e1e-23d9-44e7-8925-a0ce2504e6e5/#" } } rows { name { value: "enrichment_service-account-enrichment" } } rows { quad { s_iri { prefix_id: 5 name_id: 49 } p_iri { prefix_id: 15 name_id: 14 } o_literal { lex: "service-account-enrichment" } } } rows { prefix { id: 7 value: "http://xmlns.com/foaf/0.1/" } } rows { name { value: "Agent" } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 7 name_id: 50 } } } rows { prefix { value: "https://w3id.org/ro-id/8c5d4e1e-23d9-44e7-8925-a0ce2504e6e5/" } } rows { name { value: "about" } } rows { quad { s_iri { prefix_id: 8 name_id: 2 } p_iri { prefix_id: 15 name_id: 51 } o_iri { prefix_id: 14 name_id: 12 } } } rows { quad { o_iri { name_id: 16 } } } rows { quad { o_iri { } } } rows { quad { o_iri { } } } rows { name { value: "author" } } rows { prefix { } } rows { name { value: "mailto:nathalie.reuter@rohub.com" } } rows { quad { p_iri { prefix_id: 15 name_id: 52 } o_iri { prefix_id: 9 } } } rows { name { value: "contentSize" } } rows { datatype { value: "http://www.w3.org/2001/XMLSchema#integer" } } rows { quad { p_iri { prefix_id: 15 } o_literal { lex: "8982" datatype: 1 } } } rows { name { value: "contentUrl" } } rows { quad { p_iri { } o_literal { lex: "https://api.rohub.org/api/ros/8c5d4e1e-23d9-44e7-8925-a0ce2504e6e5/crate/download/" } } } rows { name { value: "creator" } } rows { name { value: "mailto:georgehadib@gmail.com" } } rows { quad { p_iri { } o_iri { prefix_id: 9 } } } rows { name { value: "dateCreated" } } rows { quad { p_iri { prefix_id: 15 } o_literal { lex: "2022-03-22 02:02:04.214260+00:00" } } } rows { name { value: "dateModified" } } rows { quad { p_iri { } o_literal { lex: "2025-03-05 00:45:29.408393+00:00" } } } rows { name { value: "datePublished" } } rows { quad { p_iri { } o_literal { lex: "2022-03-22 02:02:04.214260+00:00" } } } rows { quad { p_iri { name_id: 13 } o_literal { lex: "Files are seperated based on MD simulations and continuum electrostatics calculations. All the input/analysis files are present in corresponding directories/sub-directories. If you have trouble navigating, please send email to LINK: mailto:reza.611@gmail.com.\n\n### Some raw trajectories are not removed as I have to repeatedly use them for others.\n\n# For the simulations and/or calculations please go to the \"simulations_analyses/\" directory, which is divided into two groups: \"MD_simulations/\" and \"continuum_electrostatics/\". All the subfolder has long names to distinguish the content of the folder (i.e. pi_plc_dmpg_100_1st_run/). All the necessary scripts are also present in the scr directory or other subdirectories. If you have trouble finding any file, please send email to LINK: mailto:reza.611@gmail.com.\n\n# For the manuscript files, please go to the \"Manuscript_files_figures_raw_data/\" directory. If you unzip the \"Files_for_archive_Orinoco_BPJ_2016\" folder and enter, you will get all the plots and raw data in the \"Redo_data_and_plots_23_04_2015\". This should be the final version. If you want to track the source of the raw data, please go to the \"simulations_analyses/\" directory. The folders for figures are named according to the content of the figure rather than Figure_1/Figure_2, as they change their places often in a manuscript. This was for my easiness of keeping track.\n\nAs for the manuscript files, the first version is in the \"BtPIPLC_for_BPJ\". The \"BPJ_reply_for_appeal\" directory should have all the later submission files.\n\nPlease do not hesitate to send an email in case of any questions. If you see any error please do let me know." } } } rows { name { value: "encodingFormat" } } rows { quad { p_iri { name_id: 61 } o_literal { lex: "application/ld+json" } } } rows { name { value: "hasPart" } } rows { prefix { value: "https://w3id.org/ro-id/8c5d4e1e-23d9-44e7-8925-a0ce2504e6e5/folders/" } } rows { name { value: "988d8813-306b-4981-a334-4000b7b829eb" } } rows { quad { p_iri { } o_iri { prefix_id: 10 } } } rows { name { value: "b0bb1931-b35b-4f58-b0c1-1aefb4f95799" } } rows { quad { o_iri { } } } rows { name { value: "c9b5f034-3ec4-4408-a86d-5372f64a4578" } } rows { quad { o_iri { } } } rows { name { value: "d628fe71-e002-4d8d-8645-090d8059956f" } } rows { quad { o_iri { } } } rows { name { value: "identifier" } } rows { quad { p_iri { prefix_id: 15 } o_literal { lex: "https://w3id.org/ro-id/8c5d4e1e-23d9-44e7-8925-a0ce2504e6e5" } } } rows { name { value: "license" } } rows { prefix { value: "https://choosealicense.com/no-permission/" } } rows { quad { p_iri { } o_iri { 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If you have trouble navigating, please send email to LINK.\n\n### Some raw trajectories are not removed as I have to repeatedly use them for others.\n\n# For the simulations and/or calculations please go to the \"simulations_analyses/\" directory, which is divided into two groups: \"MD_simulations/\" and \"continuum_electrostatics/\". All the subfolder has long names to distinguish the content of the folder (i.e. pi_plc_dmpg_100_1st_run/). All the necessary scripts are also present in the scr directory or other subdirectories. If you have trouble finding any file, please send email to LINK.\n\n# For the manuscript files, please go to the \"Manuscript_files_figures_raw_data/\" directory. If you unzip the \"Files_for_archive_Orinoco_BPJ_2016\" folder and enter, you will get all the plots and raw data in the \"Redo_data_and_plots_23_04_2015\". This should be the final version. If you want to track the source of the raw data, please go to the \"simulations_analyses/\" directory. The folders for figures are named according to the content of the figure rather than Figure_1/Figure_2, as they change their places often in a manuscript. This was for my easiness of keeping track.\n\nAs for the manuscript files, the first version is in the \"BtPIPLC_for_BPJ\". The \"BPJ_reply_for_appeal\" directory should have all the later submission files.\n\nPlease do not hesitate to send an email in case of any questions. 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rows { name { value: "email" } } rows { quad { s_iri { prefix_id: 9 name_id: 53 } p_iri { prefix_id: 15 name_id: 105 } o_literal { lex: "nathalie.reuter@rohub.com" } } } rows { quad { p_iri { name_id: 14 } o_literal { lex: "Nathalie Reuter" } } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 3 name_id: 50 } } } rows { prefix { id: 16 value: "https://w3id.org/np/RAtxwZP6PTcwQtLbJyAXxWSWRtBfsl7uuacoZ_ZFkHYtw/" } } rows { prefix { id: 10 value: "http://www.w3.org/ns/prov#" } } rows { name { value: "wasDerivedFrom" } } rows { prefix { id: 5 value: "https://api.rohub.org/api/ros/8c5d4e1e-23d9-44e7-8925-a0ce2504e6e5/crate/download/" } } rows { quad { s_iri { prefix_id: 16 name_id: 4 } p_iri { prefix_id: 10 name_id: 106 } o_iri { prefix_id: 5 name_id: 87 } g_iri { prefix_id: 16 name_id: 7 } } } rows { prefix { id: 11 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: 11 name_id: 1 } p_iri { prefix_id: 8 name_id: 107 } o_literal { lex: "2026-03-03T16:15:11.234+01:00" datatype: 2 } g_iri { prefix_id: 16 name_id: 9 } } } rows { prefix { id: 7 value: "https://w3id.org/kpxl/gen/terms/" } } rows { name { value: "RoCrateBot" } } rows { quad { p_iri { prefix_id: 8 name_id: 56 } o_iri { prefix_id: 7 name_id: 108 } } } rows { prefix { id: 14 value: "http://purl.org/nanopub/x/" } } rows { name { value: "introduces" } } rows { quad { p_iri { prefix_id: 14 } o_iri { prefix_id: 12 name_id: 2 } } } rows { name { value: "RoCrateNanopub" } } rows { quad { p_iri { prefix_id: 6 name_id: 10 } o_iri { prefix_id: 14 name_id: 110 } } } 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: "2016_Khan_etal_BPJ" } } } rows { name { value: "sig" } } rows { name { value: "hasAlgorithm" } } rows { quad { s_iri { prefix_id: 16 } p_iri { prefix_id: 14 } o_literal { lex: "RSA" } } } rows { name { value: "hasPublicKey" } } rows { quad { p_iri { } o_literal { lex: "MIIBIjANBgkqhkiG9w0BAQEFAAOCAQ8AMIIBCgKCAQEAxszSDYX5tuCSkP7UiCtftYPFNQVTjgNu0I5fwdML2DLRDlp0xzmsQXRk8oHuvwGvG1aMjj6cpUqO+0rz2Sg/wvHOgUpkRH8VJXvmlkhafMLCMtUtk5JIx7e+fkzCby+fnmD7kMkGLrT+OaExWwEDmNlCAt0TPKcHSdwsjso2isXjtAsGevyCMke8ufnFYpjs746JES1eNzVnHnn2Kp/lqcm60GM+J8dLgRZp7fX0anW098xhKym6+xXFzqeju0vYRIHBPerv+r7skWxwk+a7Sd8msqVeYEv6NTqnyWvyWb6Yh8cvj04N6qm/T6C5FUPLQhzSaQgMVMU6yLqjPuu9DwIDAQAB" } } } rows { name { value: "hasSignature" } } rows { quad { p_iri { } o_literal { lex: "uUYrd2K1sEsh1RqJKLt1EehgNTUBsyzsHcG2uUeXuXPnDDCCcT77bVQOI7cc7hUumkRRVHAcqiTp0y97xEkMQKb0ln2cVKOrGsRE0N94hkMUgbMzir+Kd2ihPpF4ELxtIxqRnP9tFeEc6Fdd1GUZMrohN8cTPp1OgT5cr4og0P0ZTrPnBDSPZdPg+/4v4Sp/gEYCG6VPJM51m45NAOVZAwhhbCTt8Hmu3G8kvCampqtaPi5+Pzx4MUrxJLQMzxymk1JF4c4SfU3AUVbLDP8VHJagsnWBwEM+QuRhKIpHQ0BgmQpdTzuoMa47e+2DLY+lkgWm/vurtEqi/CDJHr5ceg==" } } } rows { name { value: "hasSignatureTarget" } } rows { quad { p_iri { } o_iri { prefix_id: 11 name_id: 1 } } } rows { name { value: "signedBy" } } rows { quad { p_iri { prefix_id: 14 name_id: 117 } o_iri { prefix_id: 7 name_id: 108 } } }