cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/cc10q923
title: CCDC 944944: Experimental Crystal Structure Determination

description: Related Article: Yong-Kun Jiao, Xiu-Ping Li, Cui Zhao, Jiong-Peng Zhao, Fu-Chen Liu|2013|Inorg.Chem.Commun.|36|59|doi:10.1016/j.inoche.2013.08.009
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/cc10q934
title: CCDC 944945: Experimental Crystal Structure Determination

description: Related Article: Yong-Kun Jiao, Xiu-Ping Li, Cui Zhao, Jiong-Peng Zhao, Fu-Chen Liu|2013|Inorg.Chem.Commun.|36|59|doi:10.1016/j.inoche.2013.08.009
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/cc10q956
title: CCDC 944947: Experimental Crystal Structure Determination

description: Related Article: Huijie Lun, Yamin Li, Xudong Zhang, Jing-He Yang, Changyu Xiao, Yanqing Xu, Junrui Li|2014|J.Solid State Chem.|215|277|doi:10.1016/j.jssc.2014.04.016
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/cc10q967
title: CCDC 944948: Experimental Crystal Structure Determination

description: Related Article: Huijie Lun, Yamin Li, Xudong Zhang, Jing-He Yang, Changyu Xiao, Yanqing Xu, Junrui Li|2014|J.Solid State Chem.|215|277|doi:10.1016/j.jssc.2014.04.016
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/cc103b4l
title: CCDC 926718: Experimental Crystal Structure Determination

description: Related Article: Chong-Qing Wan, Ya Zhang, Xin-Zhan Sun, Hao-Jie Yan|2014|CrystEngComm|16|2959|doi:10.1039/C3CE42404A
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/ccsy764
title: CCDC 743076: Experimental Crystal Structure Determination

description: Related Article: Chong-Qing Wan, Ya Zhang, Xin-Zhan Sun, Hao-Jie Yan|2014|CrystEngComm|16|2959|doi:10.1039/C3CE42404A
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/cc103b6n
title: CCDC 926720: Experimental Crystal Structure Determination

description: Related Article: Chong-Qing Wan, Ya Zhang, Xin-Zhan Sun, Hao-Jie Yan|2014|CrystEngComm|16|2959|doi:10.1039/C3CE42404A
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/cc10q978
title: CCDC 944949: Experimental Crystal Structure Determination

description: Related Article: S.-H. Zhang, H.-W. Xi, K.H. Lim, C.-W. So|2013|Angew.Chem.,Int.Ed.|52|12364|doi:10.1002/anie.201305567
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/cc10q989
title: CCDC 944950: Experimental Crystal Structure Determination

description: Related Article: S.-H. Zhang, H.-W. Xi, K.H. Lim, C.-W. So|2013|Angew.Chem.,Int.Ed.|52|12364|doi:10.1002/anie.201305567
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/cc105t33
title: CCDC 929104: Experimental Crystal Structure Determination

description: Related Article: Danila Vasilchenko , Sergey Tkachev , Iraida Baidina , and Sergey Korenev|2013|Inorg.Chem.|52|10532|doi:10.1021/ic401499j
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/cc10d7wj
title: CCDC 935297: Experimental Crystal Structure Determination

description: Related Article: Haresh Sivaram,Jackie Tan,Han Vinh Huynh|2013|Dalton Trans.|42|12421|doi:10.1039/C3DT51071A
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/cc10q9gh
title: CCDC 944956: Experimental Crystal Structure Determination

description: Related Article: Zheng-Jun Quan, Miao-Miao Wang, Liang-Jie Yang, Yu-Xia Da, Zhang Zhang, Xi-Cun Wang|2014|Heterocyclic Communications|20|1|doi:10.1515/hc-2013-0175
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/cc10d7xk
title: CCDC 935298: Experimental Crystal Structure Determination

description: Related Article: Haresh Sivaram,Jackie Tan,Han Vinh Huynh|2013|Dalton Trans.|42|12421|doi:10.1039/C3DT51071A
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/cc10d7yl
title: CCDC 935299: Experimental Crystal Structure Determination

description: Related Article: Haresh Sivaram,Jackie Tan,Han Vinh Huynh|2013|Dalton Trans.|42|12421|doi:10.1039/C3DT51071A
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/cc10d7zm
title: CCDC 935300: Experimental Crystal Structure Determination

description: Related Article: Haresh Sivaram,Jackie Tan,Han Vinh Huynh|2013|Dalton Trans.|42|12421|doi:10.1039/C3DT51071A
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/cc10d80p
title: CCDC 935301: Experimental Crystal Structure Determination

description: Related Article: Haresh Sivaram,Jackie Tan,Han Vinh Huynh|2013|Dalton Trans.|42|12421|doi:10.1039/C3DT51071A
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.cc10q9jk
title: CCDC 944958: Experimental Crystal Structure Determination

description: Related Article: Se Woong Lee, Seong Wook Lim, Soon Hee Park, Kwang Ha, Keun Sik Kim, Se Min Oh, Jin Yong Lee, Gon Seo|2013|Korean J. Chem. Eng.|30|2241|doi:10.1007/s11814-013-0171-z
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/cc10q9lm
title: CCDC 944960: Experimental Crystal Structure Determination

description: Related Article: R. Dubey, M.S. Pavan, T.N. Guru Row, G.R. Desiraju|2014|IUCrJ|1|8|doi:10.1107/S2052252513024421
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/cc10q9mn
title: CCDC 944961: Experimental Crystal Structure Determination

description: Related Article: R. Dubey, M.S. Pavan, T.N. Guru Row, G.R. Desiraju|2014|IUCrJ|1|8|doi:10.1107/S2052252513024421
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/cc10q9np
title: CCDC 944962: Experimental Crystal Structure Determination

description: Related Article: R. Dubey, M.S. Pavan, T.N. Guru Row, G.R. Desiraju|2014|IUCrJ|1|8|doi:10.1107/S2052252513024421
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/cc10q9pq
title: CCDC 944963: Experimental Crystal Structure Determination

description: Related Article: R. Dubey, M.S. Pavan, T.N. Guru Row, G.R. Desiraju|2014|IUCrJ|1|8|doi:10.1107/S2052252513024421
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.cc10q9vw
title: CCDC 944968: Experimental Crystal Structure Determination

description: Related Article: Sh.-W.Sun, G.-F.Wang|2019|Kristallografiya|64|1066|doi:10.1134/S1063774519070216
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.cc10qb13
title: CCDC 944974: Experimental Crystal Structure Determination

description: Related Article: Masashi Mamada, Hiroshi Katagiri, Makoto Mizukami, Kota Honda, Tsukuru Minamiki, Ryo Teraoka, Taisuke Uemura, and Shizuo Tokito|2013|ACS Applied Materials and Interfaces|5|9670|doi:10.1021/am4027136
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.cc10qb24
title: CCDC 944975: Experimental Crystal Structure Determination

description: Related Article: Masashi Mamada, Hiroshi Katagiri, Makoto Mizukami, Kota Honda, Tsukuru Minamiki, Ryo Teraoka, Taisuke Uemura, and Shizuo Tokito|2013|ACS Applied Materials and Interfaces|5|9670|doi:10.1021/am4027136
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.cc10qb35
title: CCDC 944976: Experimental Crystal Structure Determination

description: Related Article: Xiaoping Shen, Hongbo Zhou, Jiahao Yan, Yanfeng Li, and Hu Zhou|2014|Inorg.Chem.|53|116|doi:10.1021/ic401753y
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.cc10qb57
title: CCDC 944978: Experimental Crystal Structure Determination

description: Related Article: Xiaoping Shen, Hongbo Zhou, Jiahao Yan, Yanfeng Li, and Hu Zhou|2014|Inorg.Chem.|53|116|doi:10.1021/ic401753y
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/cc10qb8b
title: CCDC 944981: Experimental Crystal Structure Determination

description: Related Article: Eiichi Kayahara, Takahiko Kouyama, Tatsuhisa Kato, Hikaru Takaya, Nobuhiro Yasuda, Shigeru Yamago|2013|Angew.Chem.,Int.Ed.|52|13722|doi:10.1002/anie.201306881
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.cc10qb68
title: CCDC 944979: Experimental Crystal Structure Determination

description: Related Article: Xiaoping Shen, Hongbo Zhou, Jiahao Yan, Yanfeng Li, and Hu Zhou|2014|Inorg.Chem.|53|116|doi:10.1021/ic401753y
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/cc10qbpr
title: CCDC 944994: Experimental Crystal Structure Determination

description: Related Article: Afşin Ahmet Kaya, Zeynep Demircioğlu, Elif Çelenk Kaya, Orhan Büyükgüngör|2014|Heterocyclic Communications|20|51|doi:10.1515/hc-2013-0160
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/cc10qbqs
title: CCDC 944995: Experimental Crystal Structure Determination

description: Related Article: Xi-Shan Huang, Bin Yang, Xue-Feng Sun, Guo-Ping Xia, Ya-Yue Liu, Lin Ma and Zhi-Gang She|2014|Helv.Chim.Acta|97|664|doi:10.1002/hlca.201300248
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/cc10q8nn
title: CCDC 944931: Experimental Crystal Structure Determination

description: Related Article: Yomaira Otero, Deisy Peña, Alejandro Arce, Muriel Hissler, Regis Réau, Ysaura De Sanctis, Edgar Ocando-Mavárez, Rubén Machado, Teresa González|2015|J.Organomet.Chem.|799-800|45|doi:10.1016/j.jorganchem.2015.08.026
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/cc10q8pp
title: CCDC 944932: Experimental Crystal Structure Determination

description: Related Article: Yomaira Otero, Deisy Peña, Alejandro Arce, Muriel Hissler, Regis Réau, Ysaura De Sanctis, Edgar Ocando-Mavárez, Rubén Machado, Teresa González|2015|J.Organomet.Chem.|799-800|45|doi:10.1016/j.jorganchem.2015.08.026
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/cc10q8qq
title: CCDC 944933: Experimental Crystal Structure Determination

description: Related Article: Yomaira Otero, Deisy Peña, Alejandro Arce, Muriel Hissler, Regis Réau, Ysaura De Sanctis, Edgar Ocando-Mavárez, Rubén Machado, Teresa González|2015|J.Organomet.Chem.|799-800|45|doi:10.1016/j.jorganchem.2015.08.026
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/ccz758m
title: CCDC 900620: Experimental Crystal Structure Determination

description: Related Article: Xiao Ma, Sheng-Min Hu, Chun-Hong Tan, Yong-Fan Zhang, Xu-Dong Zhang, Tian-Lu Sheng, and Xin-Tao Wu|2013|Inorg.Chem.|52|11343|doi:10.1021/ic401604q
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/ccz759n
title: CCDC 900621: Experimental Crystal Structure Determination

description: Related Article: Xiao Ma, Sheng-Min Hu, Chun-Hong Tan, Yong-Fan Zhang, Xu-Dong Zhang, Tian-Lu Sheng, and Xin-Tao Wu|2013|Inorg.Chem.|52|11343|doi:10.1021/ic401604q
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/cc10qbxz
title: CCDC 945001: Experimental Crystal Structure Determination

description: Related Article: Mateo Alajarin, Jose Cabrera, Pilar Sanchez-Andrada, Delia Bautista, Aurelia Pastor|2013|Eur.J.Org.Chem.|2013|7500|doi:10.1002/ejoc.201300925
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/ccz75cq
title: CCDC 900623: Experimental Crystal Structure Determination

description: Related Article: Xiao Ma, Sheng-Min Hu, Chun-Hong Tan, Yong-Fan Zhang, Xu-Dong Zhang, Tian-Lu Sheng, and Xin-Tao Wu|2013|Inorg.Chem.|52|11343|doi:10.1021/ic401604q
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/p8xnpwptm7
title: Computational identification of novel c-MET receptor tyrosine kinase inhibitors in lung cancer through pharmacophore-based screening, docking studies, ADMET evaluation and Molecular dynamic simulations

description: This dataset contains pharmacophore modelling, molecular docking results, binding poses, and MD simulation trajectory files used in the study titled "Computational identification of novel c-MET receptor tyrosine kinase inhibitors in lung cancer through pharmacophore-based screening, docking studies, ADMET evaluation, and Molecular dynamic simulations". The study includes validation of pharmacophore models, Pharmacophore based virtual screening interaction plots, trajectory analysis outputs, and some figures used for validating binding stability. The data was generated using Maestro v. 9. 0 and GROMACS (2020), and supports the findings reported in the manuscript.