cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/cc4zyxy
title: CCDC 148921: Experimental Crystal Structure Determination

description: Related Article: B.Dalhus, C.H.Gorbitz|2000|Acta Crystallogr.,Sect.B:Struct.Sci.|56|720|doi:10.1107/S0108768100002810
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/cc4zz02
title: CCDC 148924: Experimental Crystal Structure Determination

description: Related Article: B.Dalhus, C.H.Gorbitz|2000|Acta Crystallogr.,Sect.B:Struct.Sci.|56|720|doi:10.1107/S0108768100002810
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/cc4zyyz
title: CCDC 148922: Experimental Crystal Structure Determination

description: Related Article: B.Dalhus, C.H.Gorbitz|2000|Acta Crystallogr.,Sect.B:Struct.Sci.|56|720|doi:10.1107/S0108768100002810
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/cc4zyz0
title: CCDC 148923: Experimental Crystal Structure Determination

description: Related Article: B.Dalhus, C.H.Gorbitz|2000|Acta Crystallogr.,Sect.B:Struct.Sci.|56|720|doi:10.1107/S0108768100002810
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/cc54jb4
title: CCDC 153305: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jc5
title: CCDC 153306: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jd6
title: CCDC 153307: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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: 10.5281/zenodo.17314141
title: (14)-Strobl2025A-DS0022 – SLICE-1 – Tribolium castaneum AGOC{ATub'PCNA°NB-mEmerald} #2 subline long-term live imaging dataset of embryonic development acquired

description: (14)-Strobl2025A-DS0022 – SLICE-1 – Tribolium castaneum AGOC{ATub'PCNA°NB-mEmerald} #2 subline long-term live imaging dataset of embryonic development acquired
DOI: 10.5517/cc54jf7
title: CCDC 153308: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jg8
title: CCDC 153309: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jh9
title: CCDC 153310: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jkc
title: CCDC 153312: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jld
title: CCDC 153313: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jmf
title: CCDC 153314: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jng
title: CCDC 153315: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jph
title: CCDC 153316: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jqj
title: CCDC 153317: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54jrk
title: CCDC 153318: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54j82
title: CCDC 153303: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
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/cc54j93
title: CCDC 153304: Experimental Crystal Structure Determination

description: Related Article: T.J.Boyle, D.M.Pedrotty, T.M.Alam, S.C.Vick, M.A.Rodriguez|2000|Inorg.Chem.|39|5133|doi:10.1021/ic000432a
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.6084/m9.figshare.29881864
title: Efficient Active Learning Strategies for Computer Experiments

description: Active learning aims at allocating resources in an intelligent manner based on the already observed data to satisfy certain objectives such as surrogate modeling or optimizing a computationally expensive function. When a Gaussian process model is used as a surrogate, space-filling designs are commonly employed to initialize active learning. Here we propose screening designs as initial designs and a new correlation function for the Gaussian process. Specifically, we propose using the maximum one-factor-at-a-time (MOFAT) design as the initial design and a multiplicative inverse multiquadric (MIM) kernel for the correlation function. The ideas behind them are known in other fields, such as sensitivity analysis or kernel theory, but they never seem to have been used for active learning in computer experiments. We also propose an integrated MOFAT-MIM strategy that automatically incorporates screening in the model estimation step. We show that these strategies provide substantial improvement to the state-of-the-art methods for both emulation and optimization objectives. We support our findings through theory and simulations, and a real experiment on the vapor-phase infiltration process.
DOI: 10.6084/m9.figshare.29881864.v1
title: Efficient Active Learning Strategies for Computer Experiments

description: Active learning aims at allocating resources in an intelligent manner based on the already observed data to satisfy certain objectives such as surrogate modeling or optimizing a computationally expensive function. When a Gaussian process model is used as a surrogate, space-filling designs are commonly employed to initialize active learning. Here we propose screening designs as initial designs and a new correlation function for the Gaussian process. Specifically, we propose using the maximum one-factor-at-a-time (MOFAT) design as the initial design and a multiplicative inverse multiquadric (MIM) kernel for the correlation function. The ideas behind them are known in other fields, such as sensitivity analysis or kernel theory, but they never seem to have been used for active learning in computer experiments. We also propose an integrated MOFAT-MIM strategy that automatically incorporates screening in the model estimation step. We show that these strategies provide substantial improvement to the state-of-the-art methods for both emulation and optimization objectives. We support our findings through theory and simulations, and a real experiment on the vapor-phase infiltration process.
DOI: 10.6084/m9.figshare.30303553
title: First report of desmatosuchin aetosaurs (Diapsida, Archosauria) from the lower part of Dharmaram Formation and a biostratigraphic re-evaluation of the upper Triassic horizons of India

description: Two desmatosuchin aetosaurs, taxa I–II, based on isolated but distinctive paramedian osteoderms, are reported from the lower Dharmaram Formation of India. These are morphologically differentiated based on shape proportions, dorsal ornamentation, nature of anterior bar and dorsal eminence, and tongue-in-groove articulation on both medial and lateral edges (taxon I). Comparison with other aetosaurian osteoderms revealed that taxon I is the first record of <i>Desmatosuchus</i> from India. Taxon II closely resembles <i>Desmatosuchus smalli</i>, and is also assigned to Desmatosuchini. Recognition of these taxa represents the first Indian record of Desmatosuchini and augmented the diversity of endemic desmatosuchins in India as well as in Gondwana. Quantitative analyses corroborate the interrelationships of the major clades of Aetosauria and elucidate the significance of the osteoderm characters. A re-evaluation of the lowest and highest occurrences of Late Triassic tetrapod assemblages from India has led to the identification of Assemblage Eubiozones. The work highlights several new biostratigraphic insights including the absence of synchronicity between faunal and lithological boundaries, absence of diagnostic Rhaetian index fossils, considerable overlap of temporal ranges, and the absence of appreciable biochronological separation resulting in the assignment of a single Upper Maleri-Lower Dharmaram Assemblage Eubiozone of mid-to-late Norian age. LSIDurn:lsid:zoobank.org:pub:6BC1AB57-9B2D-487E-B579-AAC1ED0D2827
DOI: 10.6084/m9.figshare.30303553.v1
title: First report of desmatosuchin aetosaurs (Diapsida, Archosauria) from the lower part of Dharmaram Formation and a biostratigraphic re-evaluation of the upper Triassic horizons of India

description: Two desmatosuchin aetosaurs, taxa I–II, based on isolated but distinctive paramedian osteoderms, are reported from the lower Dharmaram Formation of India. These are morphologically differentiated based on shape proportions, dorsal ornamentation, nature of anterior bar and dorsal eminence, and tongue-in-groove articulation on both medial and lateral edges (taxon I). Comparison with other aetosaurian osteoderms revealed that taxon I is the first record of <i>Desmatosuchus</i> from India. Taxon II closely resembles <i>Desmatosuchus smalli</i>, and is also assigned to Desmatosuchini. Recognition of these taxa represents the first Indian record of Desmatosuchini and augmented the diversity of endemic desmatosuchins in India as well as in Gondwana. Quantitative analyses corroborate the interrelationships of the major clades of Aetosauria and elucidate the significance of the osteoderm characters. A re-evaluation of the lowest and highest occurrences of Late Triassic tetrapod assemblages from India has led to the identification of Assemblage Eubiozones. The work highlights several new biostratigraphic insights including the absence of synchronicity between faunal and lithological boundaries, absence of diagnostic Rhaetian index fossils, considerable overlap of temporal ranges, and the absence of appreciable biochronological separation resulting in the assignment of a single Upper Maleri-Lower Dharmaram Assemblage Eubiozone of mid-to-late Norian age. LSIDurn:lsid:zoobank.org:pub:6BC1AB57-9B2D-487E-B579-AAC1ED0D2827
DOI: 10.15156/bio/sh1154562.10fu
title: SH1154562.10FU

description: UNITE provides a unified way for delimiting, identifying, communicating, and working with DNA-based Species Hypotheses (SH). All fungal ITS sequences in the international nucleotide sequence databases are clustered to approximately the species level by applying a set of dynamic distance values (<0.5 - 3.0%). All species hypotheses are given a unique, stable name in the form of a DOI, and their taxonomic and ecological annotations are verified through distributed, web-based third-party annotation efforts. SHs are connected to a taxon name and its classification as far as possible (phylum, class, order, etc.) by taking into account identifications for all sequences in the SH. An automatically or manually designated sequence is chosen to represent each such SH. These sequences are released (https://unite.ut.ee/repository.php) for use by the scientific community in, for example, local sequence similarity searches and next-generation sequencing analysis pipelines. The system and the data are updated automatically as the number of public fungal ITS sequences grows.
DOI: 10.15156/bio/sh1154565.10fu
title: SH1154565.10FU

description: UNITE provides a unified way for delimiting, identifying, communicating, and working with DNA-based Species Hypotheses (SH). All fungal ITS sequences in the international nucleotide sequence databases are clustered to approximately the species level by applying a set of dynamic distance values (<0.5 - 3.0%). All species hypotheses are given a unique, stable name in the form of a DOI, and their taxonomic and ecological annotations are verified through distributed, web-based third-party annotation efforts. SHs are connected to a taxon name and its classification as far as possible (phylum, class, order, etc.) by taking into account identifications for all sequences in the SH. An automatically or manually designated sequence is chosen to represent each such SH. These sequences are released (https://unite.ut.ee/repository.php) for use by the scientific community in, for example, local sequence similarity searches and next-generation sequencing analysis pipelines. The system and the data are updated automatically as the number of public fungal ITS sequences grows.
DOI: 10.15156/bio/sh1154571.10fu
title: SH1154571.10FU

description: UNITE provides a unified way for delimiting, identifying, communicating, and working with DNA-based Species Hypotheses (SH). All fungal ITS sequences in the international nucleotide sequence databases are clustered to approximately the species level by applying a set of dynamic distance values (<0.5 - 3.0%). All species hypotheses are given a unique, stable name in the form of a DOI, and their taxonomic and ecological annotations are verified through distributed, web-based third-party annotation efforts. SHs are connected to a taxon name and its classification as far as possible (phylum, class, order, etc.) by taking into account identifications for all sequences in the SH. An automatically or manually designated sequence is chosen to represent each such SH. These sequences are released (https://unite.ut.ee/repository.php) for use by the scientific community in, for example, local sequence similarity searches and next-generation sequencing analysis pipelines. The system and the data are updated automatically as the number of public fungal ITS sequences grows.
DOI: 10.15156/bio/sh1154573.10fu
title: SH1154573.10FU

description: UNITE provides a unified way for delimiting, identifying, communicating, and working with DNA-based Species Hypotheses (SH). All fungal ITS sequences in the international nucleotide sequence databases are clustered to approximately the species level by applying a set of dynamic distance values (<0.5 - 3.0%). All species hypotheses are given a unique, stable name in the form of a DOI, and their taxonomic and ecological annotations are verified through distributed, web-based third-party annotation efforts. SHs are connected to a taxon name and its classification as far as possible (phylum, class, order, etc.) by taking into account identifications for all sequences in the SH. An automatically or manually designated sequence is chosen to represent each such SH. These sequences are released (https://unite.ut.ee/repository.php) for use by the scientific community in, for example, local sequence similarity searches and next-generation sequencing analysis pipelines. The system and the data are updated automatically as the number of public fungal ITS sequences grows.
DOI: 10.15156/bio/sh1154575.10fu
title: SH1154575.10FU

description: UNITE provides a unified way for delimiting, identifying, communicating, and working with DNA-based Species Hypotheses (SH). All fungal ITS sequences in the international nucleotide sequence databases are clustered to approximately the species level by applying a set of dynamic distance values (<0.5 - 3.0%). All species hypotheses are given a unique, stable name in the form of a DOI, and their taxonomic and ecological annotations are verified through distributed, web-based third-party annotation efforts. SHs are connected to a taxon name and its classification as far as possible (phylum, class, order, etc.) by taking into account identifications for all sequences in the SH. An automatically or manually designated sequence is chosen to represent each such SH. These sequences are released (https://unite.ut.ee/repository.php) for use by the scientific community in, for example, local sequence similarity searches and next-generation sequencing analysis pipelines. The system and the data are updated automatically as the number of public fungal ITS sequences grows.