cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccxzyph
title: CCDC 863898: Experimental Crystal Structure Determination

description: Related Article: Biswadip Banerji, Sumit Kumar Pramanik, Priyankar Sanphui, Sameer Nikhar, Subhas C. Biswas|2013|Chem.Biol.Drug.Des.|82|401|doi:10.1111/cbdd.12164
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/ccxzyqj
title: CCDC 863899: Experimental Crystal Structure Determination

description: Related Article: Biswadip Banerji, Sumit Kumar Pramanik, Priyankar Sanphui, Sameer Nikhar, Subhas C. Biswas|2013|Chem.Biol.Drug.Des.|82|401|doi:10.1111/cbdd.12164
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/ccy0277
title: CCDC 864008: Experimental Crystal Structure Determination

description: Related Article: Seyed Sajad Sajadikhah, Nourallah Hazeri, Malek Taher Maghsoodlou, Sayyed Mostafa Habibi-Khorassani, Anthony C. Willis|2014|Res.Chem.Intermed.|40|723|doi:10.1007/s11164-012-0997-8
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/ccy1fv7
title: CCDC 865329: Experimental Crystal Structure Determination

description: Related Article: Yoshiyuki Mizuhata, Takahiro Sato, and Norihiro Tokitoh|2012|Heterocycles|84|413|doi:10.3987/COM-11-S(P)89
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/ccy1fw8
title: CCDC 865330: Experimental Crystal Structure Determination

description: Related Article: Yoshiyuki Mizuhata, Takahiro Sato, and Norihiro Tokitoh|2012|Heterocycles|84|413|doi:10.3987/COM-11-S(P)89
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/ccy1hct
title: CCDC 865376: Experimental Crystal Structure Determination

description: Related Article: Komal M. Vyas, R. N. Jadeja, Dipak Patel, R. V. Devkar, Vivek K. Gupta|2014|Polyhedron|80|20|doi:10.1016/j.poly.2013.12.037
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/ccy1s5x
title: CCDC 865649: Experimental Crystal Structure Determination

description: Related Article: Seyed Javad Sabounchei, Mohsen Ahmadi, Fatemeh Akhlaghi, Hamid Reza Khavasi|2013|J.Chem.Sci.(Bangalore,India)|125|653|doi:10.1007/s12039-013-0402-1
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/ccy4jsc
title: CCDC 868303: Experimental Crystal Structure Determination

description: Related Article: Komal M. Vyas, R. N. Jadeja, Dipak Patel, R. V. Devkar, Vivek K. Gupta|2014|Polyhedron|80|20|doi:10.1016/j.poly.2013.12.037
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/ccy75jv
title: CCDC 870837: Experimental Crystal Structure Determination

description: Related Article: Anil S. Kuwar, Umesh A. Fegade, Kundan C. Tayade, Umesh D. Patil, Horst Puschmann, Vikas V. Gite, Dipak S. Dalal, Ratnamala S. Bendre|2013|J.Fluorescence|23|859|doi:10.1007/s10895-013-1223-9
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/ccy774j
title: CCDC 870887: Experimental Crystal Structure Determination

description: Related Article: Mohsen Ouled Mohamed Sghaier, Krystyna Holderna-Natkaniec, Piotr Czarnecki, Aneta Wozniak-Braszak, Slaheddine Chaabouni|2014|Polyhedron|79|37|doi:10.1016/j.poly.2014.04.030
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/ccy7bq6
title: CCDC 870998: Experimental Crystal Structure Determination

description: Related Article: Ana M. Felix,  Diane A. Dickie,  Ian S. Horne,  Giang Page,  and Richard A. Kemp|2012|Inorg.Chem.|51|4650|doi:10.1021/ic202583w
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/ccy7bp5
title: CCDC 870997: Experimental Crystal Structure Determination

description: Related Article: Ana M. Felix,  Diane A. Dickie,  Ian S. Horne,  Giang Page,  and Richard A. Kemp|2012|Inorg.Chem.|51|4650|doi:10.1021/ic202583w
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/ccy7bn4
title: CCDC 870996: Experimental Crystal Structure Determination

description: Related Article: Ana M. Felix,  Diane A. Dickie,  Ian S. Horne,  Giang Page,  and Richard A. Kemp|2012|Inorg.Chem.|51|4650|doi:10.1021/ic202583w
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/ccy7wpq
title: CCDC 871524: Experimental Crystal Structure Determination

description: Related Article: Xian-Bo Zhang, Ying-Hui Ren, Wen Li, Feng-Qi Zhao, Bo-Zhou Wang, Ji-Rong Song|2013|Chem.Res.Chin.Univ.|29|627|doi:10.1007/s40242-013-2350-1
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/ccy7wxy
title: CCDC 871531: Experimental Crystal Structure Determination

description: Related Article: Ju-Wen Zhang, Yan Wang, Peng-Fei Yan, Guang-Feng Hou, Guang-Ming Li|2014|Inorg.Chim.Acta|416|22|doi:10.1016/j.ica.2014.03.012
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/ccy7wyz
title: CCDC 871532: Experimental Crystal Structure Determination

description: Related Article: Ju-Wen Zhang, Yan Wang, Peng-Fei Yan, Guang-Feng Hou, Guang-Ming Li|2014|Inorg.Chim.Acta|416|22|doi:10.1016/j.ica.2014.03.012
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/ccy7wwx
title: CCDC 871530: Experimental Crystal Structure Determination

description: Related Article: Ju-Wen Zhang, Yan Wang, Peng-Fei Yan, Guang-Feng Hou, Guang-Ming Li|2014|Inorg.Chim.Acta|416|22|doi:10.1016/j.ica.2014.03.012
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/ccy998s
title: CCDC 872875: Experimental Crystal Structure Determination

description: Related Article: Yulan Zhu, Shuai Shao, Kuirong Ma, Huichao Zhao, Yongqing Qiu|2013|Monatsh.Chem.|144|1507|doi:10.1007/s00706-013-1037-0
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/ccy9ynt
title: CCDC 873507: Experimental Crystal Structure Determination

description: Related Article: Ge Song, Feng-Ying Bai, Na Xing, Chen Chen, Hui Shan, Yong-Heng Xing|2013|Chem.Res.Chin.Univ.|29|408|doi:10.1007/s40242-013-2327-0
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/ccy9ypv
title: CCDC 873508: Experimental Crystal Structure Determination

description: Related Article: Ge Song, Feng-Ying Bai, Na Xing, Chen Chen, Hui Shan, Yong-Heng Xing|2013|Chem.Res.Chin.Univ.|29|408|doi:10.1007/s40242-013-2327-0
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/ccy9ylr
title: CCDC 873505: Experimental Crystal Structure Determination

description: Related Article: Si Yue Wei, Ge Song, Fengying Bai, Zhan Shi, Yong-Heng Xing|2015|ChemPlusChem|80|1007|doi:10.1002/cplu.201402374
description: Related Article: Ge Song, Feng-Ying Bai, Na Xing, Chen Chen, Hui Shan, Yong-Heng Xing|2013|Chem.Res.Chin.Univ.|29|408|doi:10.1007/s40242-013-2327-0
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/ccy9yms
title: CCDC 873506: Experimental Crystal Structure Determination

description: Related Article: Si Yue Wei, Ge Song, Fengying Bai, Zhan Shi, Yong-Heng Xing|2015|ChemPlusChem|80|1007|doi:10.1002/cplu.201402374
description: Related Article: Ge Song, Feng-Ying Bai, Na Xing, Chen Chen, Hui Shan, Yong-Heng Xing|2013|Chem.Res.Chin.Univ.|29|408|doi:10.1007/s40242-013-2327-0
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/ccyc49q
title: CCDC 874643: Experimental Crystal Structure Determination

description: Related Article: Hiroaki Horie, Ichiro Koyama, Takuya Kurahashi and Seijiro Matsubara|2011|Chem.Commun.|47|2658|doi:10.1039/C0CC04061D
description: Related Article: Takuya Kurahashi|2014|Bull.Chem.Soc.Jpn.|87|1058|doi:10.1246/bcsj.20140158
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/ccycg3v
title: CCDC 874947: Experimental Crystal Structure Determination

description: Related Article: Qing-Wei Wang, Xiao-Fei Qi, Xiu-Mei Li, Jian-Ye Ji, Yan-Ling Niu, Bo Liu|2013|J.Inorg.Organomet.Polym.Mater.|23|1313|doi:10.1007/s10904-013-9924-8
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/ccycpdc
title: CCDC 875173: Experimental Crystal Structure Determination

description: Related Article: Yangmin Ma, Hao Wu, Jin Zhang, Yanchao Li|2013|Chirality|25|656|doi:10.1002/chir.22193
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/ccyd1kx
title: CCDC 875519: Experimental Crystal Structure Determination

description: Related Article: Sunalya M. Roy, M. R. Sudarsanakumar, S. Suma, M. R. Prathapachandra Kurup, V. S. Dhanya|2013|J.Inorg.Organomet.Polym.Mater.|23|608|doi:10.1007/s10904-013-9821-1
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/ccyd3kz
title: CCDC 875581: Experimental Crystal Structure Determination

description: Related Article: Taehyung Kim, Alan J. Lough, Ju Chang Kim|2013|Bull.Korean Chem.Soc.|34|1913|doi:10.5012/bkcs.2013.34.6.1913
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/ccyd3hx
title: CCDC 875579: Experimental Crystal Structure Determination

description: Related Article: Taehyung Kim, Alan J. Lough, Ju Chang Kim|2013|Bull.Korean Chem.Soc.|34|1913|doi:10.5012/bkcs.2013.34.6.1913
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.ccyd5n4
title: CCDC 875646: Experimental Crystal Structure Determination

description: Related Article: Cong Ma, Jie Huang, Yi Tang Zhong, Kang Zhen Xu, Ji Rong Song, Zhao Zhang|2013|Bull.Korean Chem.Soc.|34|2086|doi:10.5012/bkcs.2013.34.7.2086
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/ccydktp
title: CCDC 876023: Experimental Crystal Structure Determination

description: Related Article: A. Arunkumar, P. Ramasamy, K. Vishnu, M. K. Jayaraj|2014|J.Mater.Sci.|49|3598|doi:10.1007/s10853-013-7858-8
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/ccygpdg
title: CCDC 878056: Experimental Crystal Structure Determination

description: Related Article: Yulan Zhu, Shuai Shao, Kuirong Ma, Huichao Zhao, Yongqing Qiu|2013|Monatsh.Chem.|144|1507|doi:10.1007/s00706-013-1037-0
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/ccyj91s
title: CCDC 879595: Experimental Crystal Structure Determination

description: Related Article: Xiao-Ying Zhou, Xue-Min Jing, Da Xu, Wei-Wie Yan, Guang-Hua Li, Li-Rong Zhang|2013|Chem.Res.Chin.Univ.|29|6|doi:10.1007/s40242-013-2194-8
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/ccyjlcd
title: CCDC 879884: Experimental Crystal Structure Determination

description: Related Article: Seyyed Javad Sabounchei, Mohammad Panahimehr, Hamid Reza Khavasi, Fatame Akhlaghi Bagherjeri, Collete Boscovic|2014|Chem.Papers|68|624|doi:10.2478/s11696-013-0487-5
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: 10.25838/d5p-85
title: Data for "Mechanistic Insights into the Structural Asymmetry of the LanFEG Transporter NisFEG in Lantibiotic Immunity"

description: The archive contains the data, input files, and processing scripts. See the included README.md for detailed information.
description: Nisin is one of the best studied antimicrobial peptides. Still, how nisin-producing strains can protect themselves against nisin’s bactericidal effects is only partially understood. Located within the nisin biosynthesis operon, the heterotetrameric ABC transporter NisFEG transports nisin to the extracellular environment, granting autoimmunity to the producer strain. NisFEG belongs to the LanFEG family of ABC transporters, members of which are found in some lantibiotic-producing bacterial strains. However, their structure has not been elucidated. In this work, we constructed a full atom model of NisFEG in the ATP-bound conformation. The architecture of the complex reveals a narrow transmembrane interface with prominent lateral clefts, similar to those observed in other exporters of hydrophobic compounds. Through molecular dynamics (MD) simulations, we observed that one of the most conserved elements of the LanFEG family, the E-loop of the nucleotide binding domain, interacts preferentially with a small intracellular helix of the NisG transmembrane chain. Cosolvent MD simulations reveal the presence of a putative binding site within the lateral cleft of the transporter, next to the transmembrane chain NisE. Mutational analysis showed that large hydrophobic residues near this putative site are relevant to the transporter function, and more so than analogous residues in the opposite cleft. Our results suggest that nisin extrusion operates in an asymmetric manner, where contacts between the E-loop and NisG are the driving force for the conformational changes triggered by ATP hydrolysis, whereas the NisE subunit is the main mediator of interactions with the lantibiotic. This functional asymmetry could provide an explanation for why the LanFEG family has evolved two distinct transmembrane chains, where each one was selected to perform a single step in an optimal way, maximizing the immunity of lantibiotic-producing bacteria.
DOI: 10.34740/kaggle/dsv/13316873
title: Ethereum Price Data Binance API (2017–Now)
DOI: 10.5281/zenodo.17309024
title: Adoption of E-Recruitment in Indonesian Automated Business
DOI: 10.5281/zenodo.17309025
title: Adoption of E-Recruitment in Indonesian Automated Business
DOI: 10.5281/zenodo.17309010
title: Co-occurrence tables and Sankey diagrams of codings for critical thinking skills in quantum physics

description: This dataset contains the co-occurrence tables and Sankey diagrams obtained from a qualitative coding process applied to open-ended questions on introductory quantum physics. The analysis was conducted within the framework of a philosophical teaching strategy designed to foster higher-order critical thinking skills—analysis, synthesis, and evaluation—among engineering students. Coding relationships were identified using Atlas.ti, and the data derive from two independent cohorts analyzed in 2024