cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/cc9rs5z
title: CCDC 290971: Experimental Crystal Structure Determination

description: Related Article: A.de Meijere, L.Zhao, V.N.Belov, M.Bossi, M.Noltemeyer, S.W.Hell|2007|Chem.-Eur.J.|13|2503|doi:10.1002/chem.200601316
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/3sc-qlj-rmh
title: Senecio squalidus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/cc9rs60
title: CCDC 290972: Experimental Crystal Structure Determination

description: Related Article: A.de Meijere, L.Zhao, V.N.Belov, M.Bossi, M.Noltemeyer, S.W.Hell|2007|Chem.-Eur.J.|13|2503|doi:10.1002/chem.200601316
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5281/zenodo.17373135
title: Semantic Code Analysis for NFR Prioritization Using LLMs

description: Research Context: Non-Functional Requirements (NFRs) play a vital role in ensuring software quality, particularly in domains where failures in performance or security can lead to serious consequences. However, in organizational environments, the elicitation and prioritization of NFRs are often hindered by limited documentation and subjective decision-making. This study explores how semantic analysis of source code can support automated NFR prioritization using Large Language Models (LLMs).

Practical Problem: Conventional prioritization techniques—such as AHP and MoSCoW—depend heavily on stakeholder input and are rarely applied systematically to NFRs, especially in large-scale or poorly documented systems. This gap increases the risk of overlooking critical quality attributes.

Proposed Solution: We present a semantic code analysis pipeline that leverages LLMs to extract, classify, and prioritize NFRs directly from source code. The method uses structured prompts to guide the identification of quality attributes, aligning them with ISO/IEC 25010 categories and assigning priority levels (High, Medium, Low).

Theoretical Foundation: Grounded in Software Quality and Requirements Engineering theories, the approach integrates decision-making models and quality frameworks to support organizational needs.

Methodology: The pipeline was empirically evaluated on the OpenMRS repository (134 Java files), comparing automated outputs with expert annotations. Performance was measured using precision, recall, and F1-score.

Results: The system identified 422 NFRs, achieving 93.4% recall, 30.3% precision, and a 45.8% F1-score. High-priority requirements were predominantly related to Security and Performance Efficiency, reflecting the critical nature of the system.
DOI: 10.5281/zenodo.17373136
title: Semantic Code Analysis for NFR Prioritization Using LLMs

description: Research Context: Non-Functional Requirements (NFRs) play a vital role in ensuring software quality, particularly in domains where failures in performance or security can lead to serious consequences. However, in organizational environments, the elicitation and prioritization of NFRs are often hindered by limited documentation and subjective decision-making. This study explores how semantic analysis of source code can support automated NFR prioritization using Large Language Models (LLMs).

Practical Problem: Conventional prioritization techniques—such as AHP and MoSCoW—depend heavily on stakeholder input and are rarely applied systematically to NFRs, especially in large-scale or poorly documented systems. This gap increases the risk of overlooking critical quality attributes.

Proposed Solution: We present a semantic code analysis pipeline that leverages LLMs to extract, classify, and prioritize NFRs directly from source code. The method uses structured prompts to guide the identification of quality attributes, aligning them with ISO/IEC 25010 categories and assigning priority levels (High, Medium, Low).

Theoretical Foundation: Grounded in Software Quality and Requirements Engineering theories, the approach integrates decision-making models and quality frameworks to support organizational needs.

Methodology: The pipeline was empirically evaluated on the OpenMRS repository (134 Java files), comparing automated outputs with expert annotations. Performance was measured using precision, recall, and F1-score.

Results: The system identified 422 NFRs, achieving 93.4% recall, 30.3% precision, and a 45.8% F1-score. High-priority requirements were predominantly related to Security and Performance Efficiency, reflecting the critical nature of the system.
DOI: 10.5517/ccnl4p1
title: CCDC 613263: Experimental Crystal Structure Determination

description: Related Article: G.Schroder, T.Okinaka, Y.Mimura, M.Watanabe, T.Matsuzaki, A.Hasuoka, Y.Yamamoto, S.Matsukawa, K.Akiba|2007|Chem.-Eur.J.|13|2517|doi:10.1002/chem.200601439
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.13140/rg.2.2.23339.54566
title: Autoimmunity & PML partners. HNF-1β compartmentalisation in interphase & M-phase (Hepatocyte Nuclear Factors [D12.776.260.262]).
DOI: 10.3535/2qx-v7e-wxx
title: Cirsium alatum (S. G. Gmel.) Bobrov

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnl4q2
title: CCDC 613264: Experimental Crystal Structure Determination

description: Related Article: G.Schroder, T.Okinaka, Y.Mimura, M.Watanabe, T.Matsuzaki, A.Hasuoka, Y.Yamamoto, S.Matsukawa, K.Akiba|2007|Chem.-Eur.J.|13|2517|doi:10.1002/chem.200601439
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccnl4r3
title: CCDC 613265: Experimental Crystal Structure Determination

description: Related Article: G.Schroder, T.Okinaka, Y.Mimura, M.Watanabe, T.Matsuzaki, A.Hasuoka, Y.Yamamoto, S.Matsukawa, K.Akiba|2007|Chem.-Eur.J.|13|2517|doi:10.1002/chem.200601439
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/bxe-gd1-ghy
title: Alcea kurdica (Schltdl.) Alef.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/vk5-tfh-lxr
title: Astragalus globiflorus Boiss.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnl4s4
title: CCDC 613266: Experimental Crystal Structure Determination

description: Related Article: G.Schroder, T.Okinaka, Y.Mimura, M.Watanabe, T.Matsuzaki, A.Hasuoka, Y.Yamamoto, S.Matsukawa, K.Akiba|2007|Chem.-Eur.J.|13|2517|doi:10.1002/chem.200601439
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccnl4t5
title: CCDC 613267: Experimental Crystal Structure Determination

description: Related Article: G.Schroder, T.Okinaka, Y.Mimura, M.Watanabe, T.Matsuzaki, A.Hasuoka, Y.Yamamoto, S.Matsukawa, K.Akiba|2007|Chem.-Eur.J.|13|2517|doi:10.1002/chem.200601439
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.13140/rg.2.2.36708.88961
title: Animations with R
DOI: 10.3535/sly-c8t-atj
title: Acantholimon hilariae Ikonn.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnczts
title: CCDC 607346: Experimental Crystal Structure Determination

description: Related Article: Miao Du, Zhi-Hui Zhang, Liang-Fu Tang, Xiu-Guang Wang, Xiao-Jun Zhao, S.R.Batten|2007|Chem.-Eur.J.|13|2578|doi:10.1002/chem.200600980
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/lnh-w3l-pqq
title: Alyssum bracteatum Boiss. & Buhse

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnczvt
title: CCDC 607347: Experimental Crystal Structure Determination

description: Related Article: Miao Du, Zhi-Hui Zhang, Liang-Fu Tang, Xiu-Guang Wang, Xiao-Jun Zhao, S.R.Batten|2007|Chem.-Eur.J.|13|2578|doi:10.1002/chem.200600980
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/r0x-q1x-848
title: Potamogeton gramineus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnczwv
title: CCDC 607348: Experimental Crystal Structure Determination

description: Related Article: Miao Du, Zhi-Hui Zhang, Liang-Fu Tang, Xiu-Guang Wang, Xiao-Jun Zhao, S.R.Batten|2007|Chem.-Eur.J.|13|2578|doi:10.1002/chem.200600980
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.13140/rg.2.2.16471.37287
title: Cajas solidarias rurales ¿representan realmente una solución para los grupos solidarios?
DOI: 10.5517/ccnczxw
title: CCDC 607349: Experimental Crystal Structure Determination

description: Related Article: Miao Du, Zhi-Hui Zhang, Liang-Fu Tang, Xiu-Guang Wang, Xiao-Jun Zhao, S.R.Batten|2007|Chem.-Eur.J.|13|2578|doi:10.1002/chem.200600980
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccnczyx
title: CCDC 607350: Experimental Crystal Structure Determination

description: Related Article: Miao Du, Zhi-Hui Zhang, Liang-Fu Tang, Xiu-Guang Wang, Xiao-Jun Zhao, S.R.Batten|2007|Chem.-Eur.J.|13|2578|doi:10.1002/chem.200600980
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/61b-7an-abk
title: Scrophularia horizontalis Rech. f.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnczzy
title: CCDC 607351: Experimental Crystal Structure Determination

description: Related Article: Miao Du, Zhi-Hui Zhang, Liang-Fu Tang, Xiu-Guang Wang, Xiao-Jun Zhao, S.R.Batten|2007|Chem.-Eur.J.|13|2578|doi:10.1002/chem.200600980
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccn82kj
title: CCDC 603587: Experimental Crystal Structure Determination

description: Related Article: A.F.A.Peacock, M.Melchart, R.J.Deeth, A.Habtemariam, S.Parsons, P.J.Sadler|2007|Chem.-Eur.J.|13|2601|doi:10.1002/chem.200601152
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/ps7-e38-xwv
title: Astragalus oleifolius DC.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccn82lk
title: CCDC 603588: Experimental Crystal Structure Determination

description: Related Article: A.F.A.Peacock, M.Melchart, R.J.Deeth, A.Habtemariam, S.Parsons, P.J.Sadler|2007|Chem.-Eur.J.|13|2601|doi:10.1002/chem.200601152
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccnnrhj
title: CCDC 615768: Experimental Crystal Structure Determination

description: Related Article: P.G.Hayes, W.E.Piers, M.Parvez|2007|Chem.-Eur.J.|13|2632|doi:10.1002/chem.200601087
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/bd4-z7y-gqj
title: Tocoyena sellowiana (Cham. & Schltdl.) K. Schum.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnqcyn
title: CCDC 617332: Experimental Crystal Structure Determination

description: Related Article: G.Robinson, C.Y.Tang, R.Koppe, A.R.Cowley, H.-J.Himmel|2007|Chem.-Eur.J.|13|2648|doi:10.1002/chem.200600807
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/8vm-t9x-qmr
title: Achillea grandifolia Friv.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnydcb
title: CCDC 624072: Experimental Crystal Structure Determination

description: Related Article: Chung-Hong Fang, Yao-Lun Chen, Cheng-Han Yang, Yun Chi, Yu-Shan Yeh, E.Y.Li, Yi-Ming Cheng, Chia-Jung Hsu, Pi-Tai Chou, Chin-Ti Chen|2007|Chem.-Eur.J.|13|2686|doi:10.1002/chem.200601019
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/pe4-810-0wr
title: Alyssum caespitosum Baumgartner

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccngdt9
title: CCDC 609671: Experimental Crystal Structure Determination

description: Related Article: A.Ragusa, J.M.Hayes, M.E.Light, J.D.Kilburn|2007|Chem.-Eur.J.|13|2717|doi:10.1002/chem.200601289
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc9tp2v
title: CCDC 292797: Experimental Crystal Structure Determination

description: Related Article: M.Nowak, K.Pluta, K.Suwinska, L.Straver|2007|J.Heterocycl.Chem.|44|543|doi:10.1002/jhet.5570440307
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.13140/rg.2.2.19695.74401
title: Stenotrophomonas chelatiphaga strain AYK1 16S ribosomal RNA gene, partial sequence
DOI: 10.3535/rh8-0ak-16s
title: Styrax maninul B. Walln.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp1mmy
title: CCDC 627180: Experimental Crystal Structure Determination

description: Related Article: I.Manolov, C.Maichle-Mossmer|2007|Anal.Sci.:X-Ray Struct.Anal.Online|23|x63|doi:10.2116/analscix.23.x63
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.13140/rg.2.2.10677.99043
title: Introduction à la cohomologie des groupes finis
DOI: 10.13140/rg.2.2.34585.52329
title: NAFE Kemper PV no builds
DOI: 10.3535/kz3-p1l-sx3
title: Parietaria officinalis L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/spc-pk1-knv
title: Artemisia annua L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnsk76
title: CCDC 619418: Experimental Crystal Structure Determination

description: Related Article: J.Ugolotti, S.Hellstrom, G.J.P.Britovsek, T.S.Jones, P.Hunt, A.J.P.White|2007|Dalton Trans.||1425|doi:10.1039/b700317j
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/xek-5nl-lwn
title: Elymus repens (L.) Gould

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp7mq7
title: CCDC 632949: Experimental Crystal Structure Determination

description: Related Article: J.Ugolotti, S.Hellstrom, G.J.P.Britovsek, T.S.Jones, P.Hunt, A.J.P.White|2007|Dalton Trans.||1425|doi:10.1039/b700317j
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/19r-634-4pk
title: Kickxia elatine subsp. crinita (Mabille) Greuter

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp7mr8
title: CCDC 632950: Experimental Crystal Structure Determination

description: Related Article: J.Ugolotti, S.Hellstrom, G.J.P.Britovsek, T.S.Jones, P.Hunt, A.J.P.White|2007|Dalton Trans.||1425|doi:10.1039/b700317j
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/hvd-ln2-072
title: Limodorum abortivum (L.) Sw.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccng5dn
title: CCDC 609441: Experimental Crystal Structure Determination

description: Related Article: S.C.Manna, E.Zangrando, J.Ribas, N.R.Chaudjuri|2007|Dalton Trans.||1383|doi:10.1039/b617278d
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/xmg-kpq-mms
title: Schoenus ferrugineus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp2dsx
title: CCDC 627929: Experimental Crystal Structure Determination

description: Related Article: S.C.Manna, E.Zangrando, J.Ribas, N.R.Chaudjuri|2007|Dalton Trans.||1383|doi:10.1039/b617278d
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.3535/g9g-zen-ey0
title: Rhynchanthera dichotoma (Desr.) DC.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp2dty
title: CCDC 627930: Experimental Crystal Structure Determination

description: Related Article: S.C.Manna, E.Zangrando, J.Ribas, N.R.Chaudjuri|2007|Dalton Trans.||1383|doi:10.1039/b617278d
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.