cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc1pfxpq
title: CCDC 1562514: Experimental Crystal Structure Determination

description: Related Article: Lalmohan Jhulki, Parul Dutta, Manas Kumar Santra, Marlon H. Cardoso, Karen G. N. Oshiro, Octávio L. Franco, Valerio Bertolasi, Anvarhusein A. Isab, Christopher W. Bielawski, Joydev Dinda|2018|New J.Chem.|42|13948|doi:10.1039/C8NJ02008F
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.cc1zct5b
title: CCDC 1828602: Experimental Crystal Structure Determination

description: Related Article: Arantxa Pino-Cuevas, Ana Graña, Ulrich Abram, Rosa Carballo, Ezequiel M. Vázquez-López|2018|CrystEngComm|20|4781|doi:10.1039/C8CE00874D
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.cc1zctjp
title: CCDC 1828613: Experimental Crystal Structure Determination

description: Related Article: Arantxa Pino-Cuevas, Ana Graña, Ulrich Abram, Rosa Carballo, Ezequiel M. Vázquez-López|2018|CrystEngComm|20|4781|doi:10.1039/C8CE00874D
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.cc1zsh19
title: CCDC 1840781: Experimental Crystal Structure Determination

description: Related Article: Ashutosh Shrivastava, Lalita Negi, Dinabandhu Das|2018|CrystEngComm|20|4719|doi:10.1039/C8CE00939B
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.cc1zsh2b
title: CCDC 1840782: Experimental Crystal Structure Determination

description: Related Article: Ashutosh Shrivastava, Lalita Negi, Dinabandhu Das|2018|CrystEngComm|20|4719|doi:10.1039/C8CE00939B
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.cc1zsh3c
title: CCDC 1840783: Experimental Crystal Structure Determination

description: Related Article: Ashutosh Shrivastava, Lalita Negi, Dinabandhu Das|2018|CrystEngComm|20|4719|doi:10.1039/C8CE00939B
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.cc1lt3k2
title: CCDC 1483894: Experimental Crystal Structure Determination

description: Related Article: N.K. Al Rasbi, M.D. Ward|2018|Acta Crystallogr.,Sect.C:Cryst.Struct.Chem.|74|961|doi:10.1107/S2053229618009683
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.cc1pfxqr
title: CCDC 1562515: Experimental Crystal Structure Determination

description: Related Article: Lalmohan Jhulki, Parul Dutta, Manas Kumar Santra, Marlon H. Cardoso, Karen G. N. Oshiro, Octávio L. Franco, Valerio Bertolasi, Anvarhusein A. Isab, Christopher W. Bielawski, Joydev Dinda|2018|New J.Chem.|42|13948|doi:10.1039/C8NJ02008F
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.cc1zwv6x
title: CCDC 1844010: Experimental Crystal Structure Determination

description: Related Article: Adimulam Harinath, Jayeeta Bhattacharjee, Hari Pada Nayek, Tarun K. Panda|2018|Dalton Trans.|47|12613|doi:10.1039/C8DT02032A
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.cc1zwv7y
title: CCDC 1844011: Experimental Crystal Structure Determination

description: Related Article: Adimulam Harinath, Jayeeta Bhattacharjee, Hari Pada Nayek, Tarun K. Panda|2018|Dalton Trans.|47|12613|doi:10.1039/C8DT02032A
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.cc1zwv8z
title: CCDC 1844012: Experimental Crystal Structure Determination

description: Related Article: Adimulam Harinath, Jayeeta Bhattacharjee, Hari Pada Nayek, Tarun K. Panda|2018|Dalton Trans.|47|12613|doi:10.1039/C8DT02032A
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.cc203d1l
title: CCDC 1850298: Experimental Crystal Structure Determination

description: Related Article: P. Sen, S. Kansiz, I.A. Golenya, N. Dege|2018|Acta Crystallogr.,Sect.E:Cryst.Commun.|74|1147|doi:10.1107/S2056989018009726
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.cc206kph
title: CCDC 1853356: Experimental Crystal Structure Determination

description: Related Article: Changyuan Zhang, Lianfen Chen, Kai Chen, Chuntao Wang, Zurong Xu, Huanfeng Jiang, Shifa Zhu|2018|Org.Chem.Front.|5|2510|doi:10.1039/C8QO00664D
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.cc207sqs
title: CCDC 1854535: Experimental Crystal Structure Determination

description: Related Article: E.M. Gulotty, R.J. Staples, S.M. Biros, P.P. Gaspar, N.P. Rath, W.R. Winchester|2018|Acta Crystallogr.,Sect.E:Cryst.Commun.|74|1142|doi:10.1107/S2056989018009696
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.cc207srt
title: CCDC 1854536: Experimental Crystal Structure Determination

description: Related Article: E.M. Gulotty, R.J. Staples, S.M. Biros, P.P. Gaspar, N.P. Rath, W.R. Winchester|2018|Acta Crystallogr.,Sect.E:Cryst.Commun.|74|1142|doi:10.1107/S2056989018009696
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: 10.25919/5b5b7530a39f4
title: QTOF breath samples from plasmodium falciparum CHMI trial

description: This data was collected as part of a study investigating the exhaled breath of volunteers undergoing controlled human malaria infection (CHMI) with Plasmoldium falciparum infection. Seven volunteers were recruited for the trial, and they provided breath samples both before and after drug treatment over a period of 28 days. The data also contains the ambient air samples collected at the same time as the breath collection. 

Two types of data are in this collection: GC-QTOF-MS file, with extension .D, which is proprietary to the company Agilent. The software "MassHunter", which is available to those who own any Agilent GC, LC or MS equipment, can be used to open these files. The second type of file available is of .xml type, which is an universal type and can be read using any text editor.
DOI: 10.5517/ccdc.csd.cc13sw0s
title: CCDC 1036795: Experimental Crystal Structure Determination

description: Related Article: T.N. Sanjeeva Murthy, S. Naveen, C.S. Chidan Kumar, M.K. Veeraiah, C.K. Quah, B.P. Siddaraju, I. Warad|2018|Acta Crystallogr.,Sect.E:Cryst.Commun.|74|1134|doi:10.1107/S2056989018010216
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.cc1n86sx
title: CCDC 1527239: Experimental Crystal Structure Determination

description: Related Article: Mi Zhang, Jian-Gang Xu, Ning-Ning Zhang, Jian Lu, Xue-Huan Xin, Fa-Kun Zheng, Guo-Cong Guo|2018|New J.Chem.|42|13927|doi:10.1039/C8NJ02659A
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.cc1pd3sz
title: CCDC 1560781: Experimental Crystal Structure Determination

description: Related Article: Liming Fan, Yujuan Zhang, Jinfang Liang, Xiaoqing Wang, Hongxiao Lv, Jiang Wang, Li Zhao, Xiutang Zhang|2018|CrystEngComm|20|4752|doi:10.1039/C8CE00877A
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.cc1zc6n6
title: CCDC 1828028: Experimental Crystal Structure Determination

description: Related Article: Hee-Soo So, Takaya Minami, Takumi Jindo, Shinya Matsumoto|2018|CrystEngComm|20|5317|doi:10.1039/C8CE00940F
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.cc1zyl9t
title: CCDC 1845687: Experimental Crystal Structure Determination

description: Related Article: Fabio Marchetti, Riccardo Pettinari, Corrado Di Nicola, Claudio Pettinari, Anup Paul, Alessandra Crispini, Eugenia Giorno, Francesco Lelj, Sonia Stoia, Mario Amati|2018|New J.Chem.|42|13998|doi:10.1039/C8NJ02823K
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.cc2089qb
title: CCDC 1855031: Experimental Crystal Structure Determination

description: Related Article: N. Goyal, C. Do, J.P. Donahue, J.T. Mague, M. Foroozesh|2018|IUCrData|3|x180993|doi:10.1107/S2414314618009938
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.cc208z8k
title: CCDC 1855668: Experimental Crystal Structure Determination

description: Related Article: C. Zhang, K.-L. Zhang|2018|Acta Crystallogr.,Sect.C:Cryst.Struct.Chem.|74|951|doi:10.1107/S205322961801015X
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.cc208z9l
title: CCDC 1855669: Experimental Crystal Structure Determination

description: Related Article: C. Zhang, K.-L. Zhang|2018|Acta Crystallogr.,Sect.C:Cryst.Struct.Chem.|74|951|doi:10.1107/S205322961801015X
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.cc209bg4
title: CCDC 1856015: Experimental Crystal Structure Determination

description: Related Article: F. Li, M. Zhu, L. Lu|2018|Acta Crystallogr.,Sect.C:Cryst.Struct.Chem.|74|967|doi:10.1107/S2053229618010239
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.cc1n7vc3
title: CCDC 1526885: Experimental Crystal Structure Determination

description: Related Article: F.H. Silva, C.H.J. Franco, C.C. Corrêa, R. Diniz|2018|Acta Crystallogr.,Sect.C:Cryst.Struct.Chem.|74|981|doi:10.1107/S2053229618010264
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.ccvnk9b
title: CCDC 794322: Experimental Crystal Structure Determination

description: Related Article: K. Hemanathan, C.M. Mahalakshmi, K. Anbalagan, R. Raja, K.S. Murugesan|2018|IUCrData|3|x181025|doi:10.1107/S2414314618010258
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.cc1zjgdc
title: CCDC 1833073: Experimental Crystal Structure Determination

description: Related Article: Pradnya H. Patil, Georgy A. Filonenko, Sébastien Lapointe, Robert R. Fayzullin, Julia R. Khusnutdinova|2018|Inorg.Chem.|57|10009|doi:10.1021/acs.inorgchem.8b01181
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.cc1zrfqw
title: CCDC 1839779: Experimental Crystal Structure Determination

description: Related Article: Xianghui Zheng, Wei Du, Lizhi Gai, Xuqiong Xiao, Zhifang Li, Liwen Xu, Yupeng Tian, Mitsuo Kira, Hua Lu|2018|Chem.Commun.|54|8834|doi:10.1039/C8CC04962A
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: 10.17632/8hf98wstpz.1
title: Data for: Thermal Self Polymerization Investigated by Microwave Molecular Spectroscopy - Rotational Characterization of the Methyl Methacrylate Dimer

description: Gaussian output files, Linelists and XIAM fit files as well as a more detailed description of the MD calculations.
DOI: 10.5517/ccdc.csd.cc1zrfrx
title: CCDC 1839780: Experimental Crystal Structure Determination

description: Related Article: Xianghui Zheng, Wei Du, Lizhi Gai, Xuqiong Xiao, Zhifang Li, Liwen Xu, Yupeng Tian, Mitsuo Kira, Hua Lu|2018|Chem.Commun.|54|8834|doi:10.1039/C8CC04962A
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.cc1zs41y
title: CCDC 1840440: Experimental Crystal Structure Determination

description: Related Article: Xinyue Liu, Meng Chen, Chengyi Xiao, Ning Xue, Lei Zhang|2018|Org.Lett.|20|4512|doi:10.1021/acs.orglett.8b01810
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.cc1zs42z
title: CCDC 1840441: Experimental Crystal Structure Determination

description: Related Article: Xinyue Liu, Meng Chen, Chengyi Xiao, Ning Xue, Lei Zhang|2018|Org.Lett.|20|4512|doi:10.1021/acs.orglett.8b01810
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.cc1zsb14
title: CCDC 1840626: Experimental Crystal Structure Determination

description: Related Article: Santigopal Mondal, Arghya Ghosh, Subrata Mukherjee, Akkattu T. Biju|2018|Org.Lett.|20|4499|doi:10.1021/acs.orglett.8b01799
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: 10.13021/v2dp-1q10
title: Data files from the paper “PLOS ONE Goodliffe et al., 2018 In press”
DOI: 10.5517/ccdc.csd.cc1yx1ws
title: CCDC 1814426: Experimental Crystal Structure Determination

description: Related Article: P. Singh, H.B. Singh, R.J. Butcher|2018|Acta Crystallogr.,Sect.E:Cryst.Commun.|74|1151|doi:10.1107/S2056989018010423
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.cc1z3rmg
title: CCDC 1820866: Experimental Crystal Structure Determination

description: Related Article: R. Sangeetha, K. Balasubramani, K. Thanigaimani, S. Jose Kavitha|2018|Acta Crystallogr.,Sect.E:Cryst.Commun.|74|1159|doi:10.1107/S2056989018010368
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.cc1zsh8j
title: CCDC 1840788: Experimental Crystal Structure Determination

description: Related Article: Miroslava Búdová, Eliška Skorepová, Jan Cejka|2018|Cryst.Growth Des.|18|5287|doi:10.1021/acs.cgd.8b00718
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.