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    Contextual Language Models for Knowledge Graph Completion
    (Aachen, Germany : RWTH Aachen, 2021) Russa, Biswas; Sofronova, Radina; Alam, Mehwish; Sack, Harald; Mehwish, Alam; Ali, Medi; Groth, Paul; Hitzler, Pascal; Lehmann, Jens; Paulheim, Heiko; Rettinger, Achim; Sack, Harald; Sadeghi, Afshin; Tresp, Volker
    Knowledge Graphs (KGs) have become the backbone of various machine learning based applications over the past decade. However, the KGs are often incomplete and inconsistent. Several representation learning based approaches have been introduced to complete the missing information in KGs. Besides, Neural Language Models (NLMs) have gained huge momentum in NLP applications. However, exploiting the contextual NLMs to tackle the Knowledge Graph Completion (KGC) task is still an open research problem. In this paper, a GPT-2 based KGC model is proposed and is evaluated on two benchmark datasets. The initial results obtained from the _ne-tuning of the GPT-2 model for triple classi_cation strengthens the importance of usage of NLMs for KGC. Also, the impact of contextual language models for KGC has been discussed.
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    Biobank Oversight and Sanctions Under the General Data Protection Regulation
    (Dordrecht ; Heidelberg ; New York ; London : Springer, 2021) Hallinan, Dara; Slokenberga, Santa; Tzortzatou, Olga; Reichel, Jane
    This contribution offers an insight into the function and problems of the oversight and sanctions mechanisms outlined in the General Data Protection Regulation as they relate to the biobanking context. These mechanisms might be considered as meta-mechanisms—mechanisms relating to, but not consisting of, substantive legal principles—functioning in tandem to ensure biobank compliance with data protection principles. Each of the mechanisms outlines, on paper at least, comprehensive and impressive compliance architecture—both expanding on their capacity in relation to Directive 95/46. Accordingly, each mechanism looks likely to have a significant and lasting impact on biobanks and biobanking. Despite this comprehensiveness, however, the mechanisms are not immune from critique. Problems appear regarding the standard of protection provided for research subject rights, regarding the disproportionate impact on legitimate interests tied up with the biobanking process—particularly genomic research interests—and regarding their practical implementability in biobanking.
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    Combining Textual Features for the Detection of Hateful and Offensive Language
    (Aachen, Germany : RWTH Aachen, 2021) Hakimov, Sherzod; Ewerth, Ralph; Mehta, Parth; Mandl, Thomas; Majumder, Prasenjit; Mitra, Mandar
    The detection of offensive, hateful and profane language has become a critical challenge since many users in social networks are exposed to cyberbullying activities on a daily basis. In this paper, we present an analysis of combining different textual features for the detection of hateful or offensive posts on Twitter. We provide a detailed experimental evaluation to understand the impact of each building block in a neural network architecture. The proposed architecture is evaluated on the English Subtask 1A: Identifying Hate, offensive and profane content from the post datasets of HASOC-2021 dataset under the team name TIB-VA. We compared different variants of the contextual word embeddings combined with the character level embeddings and the encoding of collected hate terms.
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    Modelling Archival Hierarchies in Practice: Key Aspects and Lessons Learned
    (Aachen, Germany : RWTH Aachen, 2021) Vafaie, Mahsa; Bruns, Oleksandra; Pilz, Nastasja; Dessì, Danilo; Sack, Harald; Sumikawa, Yasunobu; Ikejiri, Ryohei; Doucet, Antoine; Pfanzelter, Eva; Hasanuzzaman, Mohammed; Dias, Gaël; Milligan, Ian; Jatowt, Adam
    An increasing number of archival institutions aim to provide public access to historical documents. Ontologies have been designed, developed and utilised to model the archival description of historical documents and to enable interoperability between different information sources. However, due to the heterogeneous nature of archives and archival systems, current ontologies for the representation of archival content do not always cover all existing structural organisation forms equallywell. After briefly contextualising the heterogeneity in the hierarchical structure of German archives, this paper describes and evaluates differences between two archival ontologies, ArDO and RiC-O, and their approaches to modelling hierarchy levels and archive dynamics.
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    Leveraging Literals for Knowledge Graph Embeddings
    (Aachen, Germany : RWTH Aachen, 2021) Gesese, Genet Asefa; Tamma, Valentina; Fernandez, Miriam; Poveda-Villalón, María
    Nowadays, Knowledge Graphs (KGs) have become invaluable for various applications such as named entity recognition, entity linking, question answering. However, there is a huge computational and storage cost associated with these KG-based applications. Therefore, there arises the necessity of transforming the high dimensional KGs into low dimensional vector spaces, i.e., learning representations for the KGs. Since a KG represents facts in the form of interrelations between entities and also using attributes of entities, the semantics present in both forms should be preserved while transforming the KG into a vector space. Hence, the main focus of this thesis is to deal with the multimodality and multilinguality of literals when utilizing them for the representation learning of KGs. The other task is to extract benchmark datasets with a high level of difficulty for tasks such as link prediction and triple classification. These datasets could be used for evaluating both kind of KG Embeddings, those using literals and those which do not include literals.
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    On the Impact of Features and Classifiers for Measuring Knowledge Gain during Web Search - A Case Study
    (Aachen, Germany : RWTH Aachen, 2021) Gritz, Wolfgang; Hoppe, Anett; Ewerth, Ralph; Cong, Gao; Ramanath, Maya
    Search engines are normally not designed to support human learning intents and processes. The ÿeld of Search as Learning (SAL) aims to investigate the characteristics of a successful Web search with a learning purpose. In this paper, we analyze the impact of text complexity of Web pages on predicting knowledge gain during a search session. For this purpose, we conduct an experimental case study and investigate the in˝uence of several text-based features and classiÿers on the prediction task. We build upon data from a study of related work, where 104 participants were given the task to learn about the formation of lightning and thunder through Web search. We perform an extensive evaluation based on a state-of-the-art approach and extend it with additional features related to textual complexity of Web pages. In contrast to prior work, we perform a systematic search for optimal hyperparameters and show the possible in˝uence of feature selection strategies on the knowledge gain prediction. When using the new set of features, state-of-the-art results are noticeably improved. The results indicate that text complexity of Web pages could be an important feature resource for knowledge gain prediction.
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    DDB-KG: The German Bibliographic Heritage in a Knowledge Graph
    (Aachen, Germany : RWTH Aachen, 2021) Tan, Mary Ann; Tietz, Tabea; Bruns, Oleksandra; Oppenlaender, Jonas; Dessì, Danilo; Harald, Sack; Sumikawa, Yasunobu; Ikejiri, Ryohei; Doucet, Antoine; Pfanzelter, Eva; Hasanuzzaman, Mohammed; Dias, Gaël; Milligan, Ian; Jatowt, Adam
    Under the German government’s initiative “NEUSTART Kultur”, the German Digital Library or Deutsche Digitale Bibliothek (DDB) is undergoing improvements to enhance user-experience. As an initial step, emphasis is placed on creating a knowledge graph from the bibliographic record collection of the DDB. This paper discusses the challenges facing the DDB in terms of retrieval and the solutions in addressing them. In particular, limitations of the current data model or ontology to represent bibliographic metadata is analyzed through concrete examples. This study presents the complete ontological mapping from DDB-Europeana Data Model (DDB-EDM) to FaBiO, and a prototype of the DDB-KG made available as a SPARQL endpoint. The suitabiliy of the target ontology is demonstrated with SPARQL queries formulated from competency questions.
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    Persistent peri-Heptacene: Synthesis and In Situ Characterization
    (Weinheim : Wiley-VCH, 2021) Ajayakumar, M.R.; Ma, Ji; Lucotti, Andrea; Schellhammer, Karl Sebastian; Serra, Gianluca; Dmitrieva, Evgenia; Rosenkranz, Marco; Komber, Hartmut; Liu, Junzhi; Ortmann, Frank; Tommasini, Matteo; Feng, Xinliang
    n-peri-Acenes (n-PAs) have gained interest as model systems of zigzag-edged graphene nanoribbons for potential applications in nanoelectronics and spintronics. However, the synthesis of n-PAs larger than peri-tetracene remains challenging because of their intrinsic open-shell character and high reactivity. Presented here is the synthesis of a hitherto unknown n-PA, that is, peri-heptacene (7-PA), in which the reactive zigzag edges are kinetically protected with eight 4-tBu-C6H4 groups. The formation of 7-PA is validated by high-resolution mass spectrometry and in situ FT-Raman spectroscopy. 7-PA displays a narrow optical energy gap of 1.01 eV and exhibits persistent stability (t1/2≈25 min) under inert conditions. Moreover, electron-spin resonance measurements and theoretical studies reveal that 7-PA exhibits an open-shell feature and a significant tetraradical character. This strategy could be considered a modular approach for the construction of next-generation (3 N+1)-PAs (where N≥3). © 2021 The Authors. Angewandte Chemie International Edition published by Wiley-VCH GmbH
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    A General and Highly Selective Palladium-Catalyzed Hydroamidation of 1,3-Diynes
    (Weinheim : Wiley-VCH, 2021) Liu, Jiawang; Schneider, Carolin; Yang, Ji; Wei, Zhihong; Jiao, Haijun; Franke, Robert; Jackstell, Ralf; Beller, Matthias
    A chemo-, regio-, and stereoselective mono-hydroamidation of (un)symmetrical 1,3-diynes is described. Key for the success of this novel transformation is the utilization of an advanced palladium catalyst system with the specific ligand Neolephos. The synthetic value of this general approach to synthetically useful α-alkynyl-α, β-unsaturated amides is showcased by diversification of several structurally complex molecules and marketed drugs. Control experiments and density-functional theory (M06L-SMD) computations also suggest the crucial role of the substrate in controlling the regioselectivity of unsymmetrical 1,3-diynes. © 2020 The Authors. Published by Wiley-VCH GmbH
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    A Two-Dimensional Polyimide-Graphene Heterostructure with Ultra-fast Interlayer Charge Transfer
    (Weinheim : Wiley-VCH, 2021) Liu, Kejun; Li, Jiang; Qi, Haoyuan; Hambsch, Mike; Rawle, Jonathan; Vázquez, Adrián Romaní; Nia, Ali Shaygan; Pashkin, Alexej; Schneider, Harald; Polozij, Mirosllav; Heine, Thomas; Helm, Manfred; Mannsfeld, Stefan C.B.; Kaiser, Ute; Dong, Renhao; Feng, Xinliang
    Two-dimensional polymers (2DPs) are a class of atomically/molecularly thin crystalline organic 2D materials. They are intriguing candidates for the development of unprecedented organic–inorganic 2D van der Waals heterostructures (vdWHs) with exotic physicochemical properties. In this work, we demonstrate the on-water surface synthesis of large-area (cm2), monolayer 2D polyimide (2DPI) with 3.1-nm lattice. Such 2DPI comprises metal-free porphyrin and perylene units linked by imide bonds. We further achieve a scalable synthesis of 2DPI-graphene (2DPI-G) vdWHs via a face-to-face co-assembly of graphene and 2DPI on the water surface. Remarkably, femtosecond transient absorption spectroscopy reveals an ultra-fast interlayer charge transfer (ca. 60 fs) in the resultant 2DPI-G vdWH upon protonation by acid, which is equivalent to that of the fastest reports among inorganic 2D vdWHs. Such large interlayer electronic coupling is ascribed to the interlayer cation–π interaction between 2DP and graphene. © 2021 The Authors. Angewandte Chemie International Edition published by Wiley-VCH GmbH