cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/cc1079bw
title: CCDC 930537: Experimental Crystal Structure Determination

description: Related Article: Sergey A. Adonin, Maxim N. Sokolov, Anton I. Smolentsev, Svetlana G. Kozlova, Vladimir P. Fedin|2013|Dalton Trans.|42|9818|doi:10.1039/C3DT51048D
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/cc1079q8
title: CCDC 930549: Experimental Crystal Structure Determination

description: Related Article: Rupam Sen, Debraj Saha, Dasarath Mal, Paula Brandão, Zhi Lin|2013|Eur.J.Inorg.Chem.|2013|5103|doi:10.1002/ejic.201300560
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/cc1079p7
title: CCDC 930548: Experimental Crystal Structure Determination

description: Related Article: Rupam Sen, Debraj Saha, Dasarath Mal, Paula Brandão, Zhi Lin|2013|Eur.J.Inorg.Chem.|2013|5103|doi:10.1002/ejic.201300560
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/cc107bcy
title: CCDC 930569: Experimental Crystal Structure Determination

description: Related Article: Zehuai Mou, Bo Liu, Meiyan Wang, Hongyan Xie, Ping Li, Lei Li, Shihui Li, Dongmei Cui|2014|Chem.Commun.|50|11411|doi:10.1039/C4CC05033A
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/cc107b8v
title: CCDC 930566: Experimental Crystal Structure Determination

description: Related Article: Zehuai Mou, Bo Liu, Meiyan Wang, Hongyan Xie, Ping Li, Lei Li, Shihui Li, Dongmei Cui|2014|Chem.Commun.|50|11411|doi:10.1039/C4CC05033A
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/cc107b9w
title: CCDC 930567: Experimental Crystal Structure Determination

description: Related Article: Zehuai Mou, Bo Liu, Meiyan Wang, Hongyan Xie, Ping Li, Lei Li, Shihui Li, Dongmei Cui|2014|Chem.Commun.|50|11411|doi:10.1039/C4CC05033A
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: 10.6084/m9.figshare.30326728
title: Data for: Sustained visual signals in the primate cerebellar dentate nucleus drive associative learning

description: Data for the study "Sustained visual signals in the primate cerebellar dentate nucleus drive associative learning" by Yusuke Akiyama, Hiroshi Yamada, Masayuki Matsumoto, & Jun Kunimatsu.
DOI: 10.6084/m9.figshare.30326728.v1
title: Data for: Sustained visual signals in the primate cerebellar dentate nucleus drive associative learning

description: Data for the study "Sustained visual signals in the primate cerebellar dentate nucleus drive associative learning" by Yusuke Akiyama, Hiroshi Yamada, Masayuki Matsumoto, & Jun Kunimatsu.
DOI: 10.5281/zenodo.17217896
title: Hessian Dataset for Optimizing Reactive MLIP(HORM) Dataset

description: The Hessian dataset for Optimizing Reactive MLIP (HORM) comprising 1.84 million Hessian matrices computed at the ωB97x/6-31G(d) level of theory. The geometries in the HORM dataset are sampled from two reactive datasets, Transition1x and RGD1. To ensure consistency in the level of theory, all sampled geometries were recomputed by GPU4PYSCF at the ω B97X/6-31G* level of theory to obtain energies, forces, and Hessian matrices. The usage of the datasets and data types are shown in the file 'how-to-load-the-lmdb-files.ipynb'.
DOI: 10.5281/zenodo.17217897
title: Hessian Dataset for Optimizing Reactive MLIP(HORM) Dataset

description: The Hessian dataset for Optimizing Reactive MLIP (HORM) comprising 1.84 million Hessian matrices computed at the ωB97x/6-31G(d) level of theory. The geometries in the HORM dataset are sampled from two reactive datasets, Transition1x and RGD1. To ensure consistency in the level of theory, all sampled geometries were recomputed by GPU4PYSCF at the ω B97X/6-31G* level of theory to obtain energies, forces, and Hessian matrices. The usage of the datasets and data types are shown in the file 'how-to-load-the-lmdb-files.ipynb'.
DOI: 10.18150/xyjwiu
title: Antroponimia łotewskich Polaków. Rzeżyca

description: Przedmiotem badań zrealizowanych w ramach projektu „Antroponimia łotewskich Polaków” są nazwy osobowe łatgalskich Polaków na przykładzie Rzeżycy.Badania przeprowadzono w Rzeżycy (Rēzekne), położonej w historycznej Łatgalii, tj. na terenie tzw. Inflant polskich.Materiał badawczy pozyskano metodami: terenową, ankietową oraz wywiadu.Praca zawiera wykazy antroponimów – imion i nazwisk – zgromadzonych podczas wyjazdu badawczego.Praca powstała w wyniku realizacji projektu badawczego o nr 2024/08/X/HS2/00767 finansowanego ze środków Narodowego Centrum Nauki.
DOI: 10.5281/zenodo.17309926
title: Lazanaki&Tsoni Dataset

description: This study examined how workplace bullying influences employee performance through the psychological mechanisms of well-being, work engagement, and anxiety. Drawing on the Job Demands–Resources (JD–R) and Conservation of Resources (COR) frameworks, bullying was conceptualized as a social job demand that depletes employees’ personal resources and triggers strain. A sample of 250 employees from the Greek private sector completed validated measures of workplace bullying, psychological well-being, work engagement, anxiety, and three dimensions of job performance—task, contextual, and counterproductive work behavior (CWB). Correlational and regression analyses revealed that bullying was negatively associated with well-being and engagement and positively with anxiety. Mediation analyses using PROCESS Model 4 confirmed that well-being and engagement partially mediated the negative effects of bullying on task and contextual performance and the positive effects on CWB, while anxiety transmitted additional variance, particularly to counterproductive behaviors. Overall, workplace bullying emerged as both a psychosocial hazard and a core performance risk. The findings extend JD–R and COR by integrating resource-based and strain-based pathways and emphasize the need for organizational strategies that prevent bullying, safeguard psychological resources, and foster engagement to sustain performance and well-being.
DOI: 10.5281/zenodo.17309927
title: Lazanaki&Tsoni Dataset

description: This study examined how workplace bullying influences employee performance through the psychological mechanisms of well-being, work engagement, and anxiety. Drawing on the Job Demands–Resources (JD–R) and Conservation of Resources (COR) frameworks, bullying was conceptualized as a social job demand that depletes employees’ personal resources and triggers strain. A sample of 250 employees from the Greek private sector completed validated measures of workplace bullying, psychological well-being, work engagement, anxiety, and three dimensions of job performance—task, contextual, and counterproductive work behavior (CWB). Correlational and regression analyses revealed that bullying was negatively associated with well-being and engagement and positively with anxiety. Mediation analyses using PROCESS Model 4 confirmed that well-being and engagement partially mediated the negative effects of bullying on task and contextual performance and the positive effects on CWB, while anxiety transmitted additional variance, particularly to counterproductive behaviors. Overall, workplace bullying emerged as both a psychosocial hazard and a core performance risk. The findings extend JD–R and COR by integrating resource-based and strain-based pathways and emphasize the need for organizational strategies that prevent bullying, safeguard psychological resources, and foster engagement to sustain performance and well-being.
DOI: 10.34740/kaggle/dsv/13318685
title: Peer-to-Peer Boliviano (BOB) Exchange Data
DOI: 10.5517/ccdc.csd.ccsbs51
title: CCDC 725343: Experimental Crystal Structure Determination

description: Related Article: Nafisa Younas, Muhammad Abid Rashid, Sadia Nazir, Muhammad Usman, Raja Adil Sarfraz, Amer Jamil, Adrian Charles Whitwood|2017|J.Mol.Liq.|240|351|doi:10.1016/j.molliq.2017.05.052
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/ccdc.csd.ccw2vtl
title: CCDC 807110: Experimental Crystal Structure Determination

description: Related Article: Keiichi Katoh, Yu Aizawa, Takaumi Morita, Brian Breedlove, Masahiro Yamashita|2017|Chem.-Eur.J.|23|15377|doi:10.1002/chem.201703014
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: 10.6084/m9.figshare.30326650
title: <b>Integrated Immune Profiling of Chordomas Reveals Spatially Organized Niches and Functional Heterogeneity</b>

description: This dataset contains the processed single-cell RNA sequencing (scRNA-seq) data used in the study <i>“Integrated Immune Profiling of Chordomas Reveals Spatially Organized Niches and Functional Heterogeneity.”</i><br>The data were generated from six chordoma patients, including paired tumor and peripheral blood mononuclear cell (PBMC) samples, to characterize the immune landscape of chordomas at single-cell resolution.
DOI: 10.6084/m9.figshare.30326650.v1
title: <b>Integrated Immune Profiling of Chordomas Reveals Spatially Organized Niches and Functional Heterogeneity</b>

description: This dataset contains the processed single-cell RNA sequencing (scRNA-seq) data used in the study <i>“Integrated Immune Profiling of Chordomas Reveals Spatially Organized Niches and Functional Heterogeneity.”</i><br>The data were generated from six chordoma patients, including paired tumor and peripheral blood mononuclear cell (PBMC) samples, to characterize the immune landscape of chordomas at single-cell resolution.
DOI: 10.5517/ccdc.csd.ccz1p5v
title: CCDC 895347: Experimental Crystal Structure Determination

description: Related Article: Xingxing Wu, Wei Zhou, Hai-Hong Wu, Junliang Zhang|2017|Chem.Commun.|53|5661|doi:10.1039/C7CC02906C
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/cczwqbw
title: CCDC 920369: Experimental Crystal Structure Determination

description: Related Article: Gang Xiong, Hang Xu, Jian-Zhong Cui, Qing-Lun Wang, Bin Zhao|2014|Dalton Trans.|43|5639|doi:10.1039/C3DT53251H
description: Related Article: Gang Xiong, Bing Yu, Jie Dong, Ying Shi, Bin Zhao, Liang-Nian He|2017|Chem.Commun.|53|6013|doi:10.1039/C7CC01136A
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/cczwqcx
title: CCDC 920370: Experimental Crystal Structure Determination

description: Related Article: Gang Xiong, Hang Xu, Jian-Zhong Cui, Qing-Lun Wang, Bin Zhao|2014|Dalton Trans.|43|5639|doi:10.1039/C3DT53251H
description: Related Article: Gang Xiong, Bing Yu, Jie Dong, Ying Shi, Bin Zhao, Liang-Nian He|2017|Chem.Commun.|53|6013|doi:10.1039/C7CC01136A
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/cc107b4q
title: CCDC 930562: Experimental Crystal Structure Determination

description: Related Article: Zehuai Mou, Bo Liu, Meiyan Wang, Hongyan Xie, Ping Li, Lei Li, Shihui Li, Dongmei Cui|2014|Chem.Commun.|50|11411|doi:10.1039/C4CC05033A
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/cc107byj
title: CCDC 930587: Experimental Crystal Structure Determination

description: Related Article: Aaron C. Sather, Orion B. Berryman, Curtis E. Moore, Julius Rebek|2013|Chem.Commun.|49|6379|doi:10.1039/C3CC43358G
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/cc107bzk
title: CCDC 930588: Experimental Crystal Structure Determination

description: Related Article: Aaron C. Sather, Orion B. Berryman, Curtis E. Moore, Julius Rebek|2013|Chem.Commun.|49|6379|doi:10.1039/C3CC43358G
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/cc1079m5
title: CCDC 930546: Experimental Crystal Structure Determination

description: Related Article: Li Wei, Qi Wei, Zhi-En Lin, Qin Meng, Huan He, Bai-Feng Yang, Guo-Yu Yang|2014|Angew.Chem.,Int.Ed.|53|7188|doi:10.1002/anie.201402663
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/cc107ctf
title: CCDC 930614: Experimental Crystal Structure Determination

description: Related Article: Hannes Vitze, Michael Bolte, Hans-Wolfram Lerner, Matthias Wagner|2016|Eur.J.Inorg.Chem.|2016|2443|doi:10.1002/ejic.201500801
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/cc107cvg
title: CCDC 930615: Experimental Crystal Structure Determination

description: Related Article: Hannes Vitze, Michael Bolte, Hans-Wolfram Lerner, Matthias Wagner|2016|Eur.J.Inorg.Chem.|2016|2443|doi:10.1002/ejic.201500801
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/cc1079tc
title: CCDC 930552: Experimental Crystal Structure Determination

description: Related Article: Liao-Bin Dong, Xiu Gao, Fei Liu, Juan He, Xing-De Wu, Yan Li, Qin-Shi Zhao|2013|Org.Lett.|15|3570|doi:10.1021/ol401411m
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/cc1079r9
title: CCDC 930550: Experimental Crystal Structure Determination

description: Related Article: F. Liu, X-D. Wu, J. He, X. Deng, L-Y. Peng, H-R. Luo, Q-S. Zhao|2013|Tetrahedron Lett.|54|4555|doi:10.1016/j.tetlet.2013.06.083
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/cc1079sb
title: CCDC 930551: Experimental Crystal Structure Determination

description: Related Article: Liao-Bin Dong, Xiu Gao, Fei Liu, Juan He, Xing-De Wu, Yan Li, Qin-Shi Zhao|2013|Org.Lett.|15|3570|doi:10.1021/ol401411m
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/cc107d6v
title: CCDC 930626: Experimental Crystal Structure Determination

description: Related Article: Hélio Faustino, Isaac Alonso, José L. Mascareñas, Fernando López|2013|Angew.Chem.,Int.Ed.|52|6526|doi:10.1002/anie.201302713
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/cc107d7w
title: CCDC 930627: Experimental Crystal Structure Determination

description: Related Article: Hélio Faustino, Isaac Alonso, José L. Mascareñas, Fernando López|2013|Angew.Chem.,Int.Ed.|52|6526|doi:10.1002/anie.201302713
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/cc1079yh
title: CCDC 930556: Experimental Crystal Structure Determination

description: Related Article: Y.L. Li, B.D. Wu, H. Qiu, T.L. Zhang, L. Yang|2014|J.Coord.Chem.|67|2016|doi:10.1080/00958972.2014.935770
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/cc107brb
title: CCDC 930581: Experimental Crystal Structure Determination

description: Related Article: Ganesan Karthik, Jong Min Lim, A. Srinivasan, C. H. Suresh, Dongho Kim, Tavarekere K. Chandrashekar|2013|Chem.-Eur.J.|19|17011|doi:10.1002/chem.201302020
description: Related Article: Ganesan Karthik ,  Pallavee Vitti Krushna ,  A. Srinivasan ,  and Tavarekere K. Chandrashekar|2013|J.Org.Chem.|78|8496|doi:10.1021/jo401232a
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/cc107bq9
title: CCDC 930580: Experimental Crystal Structure Determination

description: Related Article: Ganesan Karthik, Jong Min Lim, A. Srinivasan, C. H. Suresh, Dongho Kim, Tavarekere K. Chandrashekar|2013|Chem.-Eur.J.|19|17011|doi:10.1002/chem.201302020
description: Related Article: Ganesan Karthik ,  Pallavee Vitti Krushna ,  A. Srinivasan ,  and Tavarekere K. Chandrashekar|2013|J.Org.Chem.|78|8496|doi:10.1021/jo401232a
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/cc107dbz
title: CCDC 930630: Experimental Crystal Structure Determination

description: Related Article: Tomas Silha,Ivan Nemec,Radovan Herchel,Zdenk Travnicek|2013|CrystEngComm|15|5351|doi:10.1039/C3CE40524A
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.