cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccnn1cp
title: CCDC 615082: Experimental Crystal Structure Determination

description: Related Article: A.Ramazani, G.Mahmoudi, L.Dolatyari, A.Morsali, Mao-Lin Hu|2007|J.Coord.Chem.|60|2115|doi:10.1080/00958970701252997
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: 10.13140/rg.2.2.28300.56967
title: Empirical data on the physicochemical, mineralogical, and thermal properties of Lignite Coals from Nigeria's Sedimentary Basin
DOI: 10.3535/5s0-nhh-52a
title: Nepeta L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/md0-j10-j93
title: Cornus sanguinea L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/pdg-q0x-tty
title: Melittis melissophyllum subsp. carpatica (Klokov) P. W. Ball

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnkqnk
title: CCDC 612859: Experimental Crystal Structure Determination

description: Related Article: Xia Li, Ting-Ting Zhang, Yan-Ling Ju, Chun-Yan Wang, Yang-Qiu Li, Lei Zhang, Qi Zhang|2007|J.Coord.Chem.|60|2121|doi:10.1080/00958970701253003
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/ccny27w
title: CCDC 623758: Experimental Crystal Structure Determination

description: Related Article: Xia Li, Ting-Ting Zhang, Yan-Ling Ju, Chun-Yan Wang, Yang-Qiu Li, Lei Zhang, Qi Zhang|2007|J.Coord.Chem.|60|2121|doi:10.1080/00958970701253003
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/fy9k9tpcvf
title: Postoperative Radiotherapy and Overall Survival in Head and Neck Merkel Cell Carcinoma: A Population-Based Cohort Study (SEER 2004–2021)

description: This supplementary dataset accompanies the manuscript entitled “Postoperative Radiotherapy and Overall Survival in Head and Neck Merkel Cell Carcinoma: A Population-Based Cohort Study (SEER 2004–2021).” This study focused on head and neck Merkel cell carcinoma (HN-MCC), a rare but highly aggressive neuroendocrine tumor. Using data from the SEER database (2004–2021), the investigators conducted a population-based cohort analysis to evaluate the impact of postoperative radiotherapy (PORT) on overall survival (OS). A total of 1,776 patients with non-metastatic HN-MCC who underwent curative-intent resection and had known radiotherapy status were included, of whom 52.9% received PORT. Because baseline risk was higher in the PORT group (e.g., greater nodal burden and poorer differentiation), 1:1 nearest-neighbor propensity score matching (PSM) was performed to balance covariates, yielding 655 well-matched pairs.

Results showed that PORT was significantly associated with improved OS both before and after matching (adjusted HR = 0.804, 95% CI 0.696–0.928, P &lt; 0.001; post-PSM P = 0.006). In the matched cohort, the absolute improvements in 3-year and 5-year OS were 4.1% and 8.2%, respectively, with a 3.0-month gain in restricted mean survival time (RMST) over 60 months, indicating a clinically meaningful survival benefit.

Subgroup analyses revealed that the greatest benefit of PORT was observed among high-risk patients, including those aged &gt; 65 years, with tumors &gt; 2 cm, T2–T4 stage, &gt; 4 positive nodes, cutaneous primaries, and diagnoses between 2016–2021. In contrast, no OS benefit was seen in low-risk subgroups (e.g., T1 stage, small tumors, minimal nodal disease), suggesting that selective de-escalation may be appropriate for these patients.

Although limited by the lack of detailed radiotherapy parameters and comorbidity data in the registry, the consistency of results across multiple analytic approaches supports the robustness of these findings. Overall, this study demonstrates that PORT significantly improves OS in resected HN-MCC, particularly among high-risk patients, and supports a risk-adapted, individualized approach to adjuvant radiotherapy.
DOI: 10.3535/h69-t3y-4rj
title: Seseli gouanii W. D. J. Koch

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/ljq-fw6-hgn
title: Holcus lanatus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/p4c-sw1-rm1
title: Epilobium parviflorum Schreb.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccpnmnl
title: CCDC 645440: Experimental Crystal Structure Determination

description: Related Article: S.-Y. Mao, M.-R. Li, Y.-X. Huang, J.-X. Mi, Z.-B. Wei, J.-T. Zhao, J.-T. Zhao, R. Kniep|2002|Z.Kristallogr.-New Cryst.Struct.|217|3|doi:10.1524/ncrs.2002.217.1.3
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: 10.3535/3af-9k5-jr3
title: Heliotropium L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/hr8-m19-dvw
title: Andropogon distachyos L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/q0s-vas-nqg
title: Gundelia munzuriensis Vitek, Yüce & Ergin

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccpnmmk
title: CCDC 645439: Experimental Crystal Structure Determination

description: Related Article: J.-X. Mi, M.-R. Li, S.-Y. Mao, Y.-X. Huang, Z.-B. Wei, J.-T. Zhao, R. Kniep|2002|Z.Kristallogr.-New Cryst.Struct.|217|5|doi:10.1524/ncrs.2002.217.jg.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: 10.5517/ccpnmpm
title: CCDC 645441: Experimental Crystal Structure Determination

description: Related Article: Y.-X. Huang, J.-X. Mi, S.-Y. Mao, Z.-B. Wei, J.-T. Zhao, R. Kniep|2002|Z.Kristallogr.-New Cryst.Struct.|217|7|doi:10.1524/ncrs.2002.217.jg.7
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/fy9k9tpcvf.1
title: Postoperative Radiotherapy and Overall Survival in Head and Neck Merkel Cell Carcinoma: A Population-Based Cohort Study (SEER 2004–2021)

description: This supplementary dataset accompanies the manuscript entitled “Postoperative Radiotherapy and Overall Survival in Head and Neck Merkel Cell Carcinoma: A Population-Based Cohort Study (SEER 2004–2021).” This study focused on head and neck Merkel cell carcinoma (HN-MCC), a rare but highly aggressive neuroendocrine tumor. Using data from the SEER database (2004–2021), the investigators conducted a population-based cohort analysis to evaluate the impact of postoperative radiotherapy (PORT) on overall survival (OS). A total of 1,776 patients with non-metastatic HN-MCC who underwent curative-intent resection and had known radiotherapy status were included, of whom 52.9% received PORT. Because baseline risk was higher in the PORT group (e.g., greater nodal burden and poorer differentiation), 1:1 nearest-neighbor propensity score matching (PSM) was performed to balance covariates, yielding 655 well-matched pairs.

Results showed that PORT was significantly associated with improved OS both before and after matching (adjusted HR = 0.804, 95% CI 0.696–0.928, P &lt; 0.001; post-PSM P = 0.006). In the matched cohort, the absolute improvements in 3-year and 5-year OS were 4.1% and 8.2%, respectively, with a 3.0-month gain in restricted mean survival time (RMST) over 60 months, indicating a clinically meaningful survival benefit.

Subgroup analyses revealed that the greatest benefit of PORT was observed among high-risk patients, including those aged &gt; 65 years, with tumors &gt; 2 cm, T2–T4 stage, &gt; 4 positive nodes, cutaneous primaries, and diagnoses between 2016–2021. In contrast, no OS benefit was seen in low-risk subgroups (e.g., T1 stage, small tumors, minimal nodal disease), suggesting that selective de-escalation may be appropriate for these patients.

Although limited by the lack of detailed radiotherapy parameters and comorbidity data in the registry, the consistency of results across multiple analytic approaches supports the robustness of these findings. Overall, this study demonstrates that PORT significantly improves OS in resected HN-MCC, particularly among high-risk patients, and supports a risk-adapted, individualized approach to adjuvant radiotherapy.
DOI: 10.3535/c59-qvh-ftc
title: Lilium L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/mce-0tb-h2q
title: Centaurea scabiosa L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/sz0-p1v-evz
title: Sisymbrium officinale (L.) Scop.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/cc97ldh
title: CCDC 275416: Experimental Crystal Structure Determination

description: Related Article: Pei-Kun Chen, Xiao-Qing Shen, Chao-Yang Ge, Jun-Feng Kou, Hong-Yun Zhang, Hong-Wei Hou, Yu Zhu, Xian-Fu Zheng, Hong-Quan Zhang|2006|Synth.React.Inorg.,Met.-Org.,Nano-Met.Chem.|36|603|doi:10.1080/15533170600910280
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: 10.3535/05s-bkz-vnn
title: Melica nutans L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/azq-dhb-q00
title: Campanula topaliana subsp. cordifolia Phitos

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/dv7-qjq-l2h
title: Diospyros lotus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/cc8wmk9
title: CCDC 264881: Experimental Crystal Structure Determination

description: Related Article: Rui Yang, Xiao-Qing Shen, Hong-Yan Mao, Hong-Yun Zhang, Qing-An Wu, Hui Wang, Hong-Wei Hou, Yu Zhu|2006|Synth.React.Inorg.,Met.-Org.,Nano-Met.Chem.|36|617|doi:10.1080/15533170600910538
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/ccp3d5b
title: CCDC 628871: Experimental Crystal Structure Determination

description: Related Article: F.Melin, C.Boudon, M.Lo, K.J.Schenk, M.Bonin, P.Ochsenbein, M.Gross, J.Weiss|2007|J.Porphyrins Phthalocyanines|11|212|doi:10.1142/S1088424607000278
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: 10.3535/3yj-0dw-cxa
title: Sisymbrium orientale L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/5mr-7f4-89x
title: Solidago virgaurea L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/jyf-3nw-xey
title: Saxifraga caesia L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp3d6c
title: CCDC 628872: Experimental Crystal Structure Determination

description: Related Article: F.Melin, C.Boudon, M.Lo, K.J.Schenk, M.Bonin, P.Ochsenbein, M.Gross, J.Weiss|2007|J.Porphyrins Phthalocyanines|11|212|doi:10.1142/S1088424607000278
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/ccp3d7d
title: CCDC 628873: Experimental Crystal Structure Determination

description: Related Article: F.Melin, C.Boudon, M.Lo, K.J.Schenk, M.Bonin, P.Ochsenbein, M.Gross, J.Weiss|2007|J.Porphyrins Phthalocyanines|11|212|doi:10.1142/S1088424607000278
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: 10.3535/awg-mwq-ja6
title: Glaucium acutidentatum Hausskn. & Bornm.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/fgw-r3b-ptk
title: Galeopsis pubescens Besser

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/lfd-897-pg6
title: Descurainia sophia (L.) Webb ex Prantl

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccny7qj
title: CCDC 623928: Experimental Crystal Structure Determination

description: Related Article: J.Paharova, J.Cernak, Z.Zak, J.Marek|2007|J.Mol.Struct.|842|117|doi:10.1016/j.molstruc.2006.12.022
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/p5jvw28tzj
title: In Silico Dataset of Environmental Fate and Ecotoxicity Parameters for 17 Pharmaceuticals

description: This dataset presents a comprehensive screening-level assessment of 17 pharmaceuticals frequently detected in coastal and estuarine environments of Brazil. Physicochemical properties and predicted environmental fate parameters were obtained using EPI Suite™ (v4.11), OPERA (v2.8), and VEGA QSAR models, while ecotoxicological endpoints were compiled from regulatory databases and predictive algorithms. The dataset integrates persistence (half-lives, biodegradability), bioaccumulation (BCF/BAF), mobility (logKoc), and aquatic toxicity (acute and chronic values for algae, daphnids, and fish), supporting PBT (Persistence–Bioaccumulation–Toxicity) and PMT (Persistence–Mobility–Toxicity) screening according to European REACH criteria.

The package includes:

10 figures (PNG format): visualising STP removal efficiencies, persistence, bioaccumulation, mobility, aquatic toxicity profiles, PBT/PMT traffic-light classification, and priority rankings.

1 supplementary table (Excel format): containing raw model outputs, classification thresholds, and consolidated screening results for all 17 pharmaceuticals.

Figure captions (DOCX format): providing detailed descriptions and methodological notes for each figure.

All files are openly available and may be reused for comparative assessments, methodological replication, or policy-relevant prioritisation of emerging pollutants in aquatic ecosystems.
DOI: 10.3535/j6m-qqz-jyj
title: Seseli annuum L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/sp3-v2c-2e8
title: Ziziphora clinopodioides Lam.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/zrh-atl-mpg
title: Melica uniflora Retz.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.17632/p5jvw28tzj.2
title: In Silico Dataset of Environmental Fate and Ecotoxicity Parameters for 17 Pharmaceuticals

description: This dataset presents a comprehensive screening-level assessment of 17 pharmaceuticals frequently detected in coastal and estuarine environments of Brazil. Physicochemical properties and predicted environmental fate parameters were obtained using EPI Suite™ (v4.11), OPERA (v2.8), and VEGA QSAR models, while ecotoxicological endpoints were compiled from regulatory databases and predictive algorithms. The dataset integrates persistence (half-lives, biodegradability), bioaccumulation (BCF/BAF), mobility (logKoc), and aquatic toxicity (acute and chronic values for algae, daphnids, and fish), supporting PBT (Persistence–Bioaccumulation–Toxicity) and PMT (Persistence–Mobility–Toxicity) screening according to European REACH criteria.

The package includes:

10 figures (PNG format): visualising STP removal efficiencies, persistence, bioaccumulation, mobility, aquatic toxicity profiles, PBT/PMT traffic-light classification, and priority rankings.

1 supplementary table (Excel format): containing raw model outputs, classification thresholds, and consolidated screening results for all 17 pharmaceuticals.

Figure captions (DOCX format): providing detailed descriptions and methodological notes for each figure.

All files are openly available and may be reused for comparative assessments, methodological replication, or policy-relevant prioritisation of emerging pollutants in aquatic ecosystems.
DOI: 10.3535/5ks-rej-gpk
title: Centaurea laconica Boiss.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/a17-bx9-33b
title: Clidemia discolor (Triana) Cogn.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/eh1-41n-mvt
title: Arum orientale M. Bieb.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/1y5-cwd-lxa
title: Linaria vulgaris Mill.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/c2j-75k-yy5
title: Gundelia glabra Mill.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.13140/rg.2.2.14590.43848
title: Success of bacterial amplification from the samples from 'Fungal control of early-stage bacterial community development in decomposing wood'
DOI: 10.3535/bx0-plk-cly
title: Lactuca quercina L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/gcw-47h-qn3
title: Viola suavis M. Bieb.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/p5t-wjg-d2l
title: Cannabis ruderalis Janisch.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.13140/rg.2.2.11484.03203
title: AGB of Mahanadi Mangroves
DOI: 10.17632/p8fy4xwm4w
title: Banknote Authentication Dataset (Preprocessed for DEA)

description: Banknote Authentication Dataset ( Preprocessed for DEA)
DOI: 10.3535/hdh-p5v-0xy
title: Chenopodium botrys L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/lzp-5kp-nzj
title: Matthiola tricuspidata (L.) R. Br.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/rxm-85l-9pa
title: Alliaria petiolata (M. Bieb.) Cavara & Grande

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.17632/p8fy4xwm4w.1
title: Banknote Authentication Dataset (Preprocessed for DEA)

description: Banknote Authentication Dataset ( Preprocessed for DEA)
DOI: 10.3535/38n-hd8-k8j
title: Waldsteinia geoides Willd.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/jt5-lzm-vhe
title: Allium cardiostemon Fisch. & C. A. Mey.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/psx-x24-a82
title: Saxifraga aizoides L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/4xd-fjg-332
title: Alchornea glandulosa Poepp.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/9r2-7kk-r91
title: Crataegus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.17632/mvx4bgspfk
title: Bank data set

description: This dataset contains information on 60 bank branches, which were used as Decision Making Units (DMUs) in the application of Data Envelopment Analysis (DEA).
The dataset includes input and output variables relevant to branch-level efficiency evaluation. These variables were collected from internal banking records and prepared in a structured format suitable for DEA modeling.

The purpose of this dataset is to provide a benchmark for evaluating branch efficiency and to support reproducibility of the experiments presented in the associated research manuscript. All branch identifiers were anonymized to ensure confidentiality, while preserving the integrity of the efficiency analysis.
DOI: 10.3535/3xz-r6y-l53
title: Rubus gayeri Király, Trávn. & Žíla

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/j6d-rag-4by
title: Xylosma G. Forst.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/mvz-4pw-tgx
title: Gundelia L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.13140/rg.2.2.25918.33609
title: suplementary.pdf
DOI: 10.3535/s2c-m46-r6a
title: Chenopodium striatiforme Murr

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/tbm-1q4-y6a
title: Cannabis sativa L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.