cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5281/zenodo.7541890
title: Assignment & prediction of 2-propanimine (CH3)2C=NH

description: The measure frequency line list, the prediction, and the XIAM and ERHAM fit input and output file of 2-propanimine [(CH3)_2C=NH] of the ground state. File description and format see ReadMe.
DOI: 10.5281/zenodo.7541889
title: Assignment & prediction of 2-propanimine (CH3)2C=NH

description: The measure frequency line list, the prediction, and the XIAM and ERHAM fit input and output file of 2-propanimine [(CH3)_2C=NH] of the ground state. File description and format see ReadMe.
DOI: 10.25773/bt54-sj65
title: Dataset: A numerical simulation of the ocean, sea ice and ice shelves in the Amundsen Sea (Antarctica) over the period 2006-2022 and its associated code and input files
DOI: 10.5066/p9kjdzxz
title: Sea level rise scenarios for the Cape Sable seaside sparrow

description: The endangered Cape Sable seaside sparrow (Ammospiza maritima mirabilis; CSSS) occurs in marl prairie habitat at the southern end of the Everglades, at the southernmost part of the Florida peninsula. The locations of three of its six subpopulations are proximate to the coast, putting them at risk for inundation caused by sea level rise (SLR). The spatially explicit predictive model EverSparrow provides probability of CSSS presence estimates based on hydrology, fire history, and vegetation. We developed two hydrologic scenarios of SLR using projections from the U.S. Army Corps of Engineers (USACE) and University of Florida's GeoPlan Center, using a modeled restoration scenario of the current landscape-scale water operations affecting CSSS habitat as the baseline. We then ran EverSparrow with the baseline and two SLR projections and examined the probability of CSSS presence within the three coastal subpopulations.
DOI: 10.6084/m9.figshare.21508098
title: CFD Data from STAR-CCM+

description: This is the dataset from Siemens STAR-CCM+, as a csv file, for both the JH- and SI- configurations at different angles of attack and aileron deflection angles. The data were used for experimental validation and work estimation compared between the whiffling-inspired gapped wing and a conventional aileron. <br> Two different subsets of this dataset are currently in use for a journal publication in work, and were presented in a paper at the 2022 ASME SMASIS conference in Dearborn, MI, titled "Computational validation that whiffling-inspired gaps require less work for roll control than conventional ailerons at high rolling moment coefficients" by Sigrest, Wu, and Inman.
DOI: 10.5517/ccdc.csd.cc2bsjsg
title: CCDC 2168536: Experimental Crystal Structure Determination

description: Related Article: Yajuan Zhang, Jie Dong, Yu Lei, Lingli Zong, Ke Zhang, Yimin Hu|2023|Org.Chem.Front.|10|304|doi:10.1039/D2QO01836E
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.cc2bsjth
title: CCDC 2168537: Experimental Crystal Structure Determination

description: Related Article: Yajuan Zhang, Jie Dong, Yu Lei, Lingli Zong, Ke Zhang, Yimin Hu|2023|Org.Chem.Front.|10|304|doi:10.1039/D2QO01836E
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.cc2bsjvj
title: CCDC 2168538: Experimental Crystal Structure Determination

description: Related Article: Yajuan Zhang, Jie Dong, Yu Lei, Lingli Zong, Ke Zhang, Yimin Hu|2023|Org.Chem.Front.|10|304|doi:10.1039/D2QO01836E
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.cc2bxfrg
title: CCDC 2172286: Experimental Crystal Structure Determination

description: Related Article: Alexander Koronatov|2022|CSD Communication|||
description: Related Article: Daniil M. Strashkov, Kirill V. Zavyalov, Pavel A. Sakharov, Anastasiya V. Agafonova, Nikolai V. Rostovskii, Alexander F. Khlebnikov, Mikhail S. Novikov|2022|Org.Chem.Front.|10|506|doi:10.1039/D2QO01759H
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.cc2c0dvn
title: CCDC 2175141: Experimental Crystal Structure Determination

description: Related Article: Anton V. Rozhkov, Eugene A. Katlenok, Margarita V. Zhmykhova, Maxim L. Kuznetsov, Victor N. Khrustalev, Kirill I. Tugashov, Nadezhda A. Bokach, Vadim Yu. Kukushkin|2023|Inorg.Chem.Front.|10|493|doi:10.1039/D2QI02047E
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.cc2c0dwp
title: CCDC 2175142: Experimental Crystal Structure Determination

description: Related Article: Anton V. Rozhkov, Eugene A. Katlenok, Margarita V. Zhmykhova, Maxim L. Kuznetsov, Victor N. Khrustalev, Kirill I. Tugashov, Nadezhda A. Bokach, Vadim Yu. Kukushkin|2023|Inorg.Chem.Front.|10|493|doi:10.1039/D2QI02047E
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.cc2c0dxq
title: CCDC 2175143: Experimental Crystal Structure Determination

description: Related Article: Anton V. Rozhkov, Eugene A. Katlenok, Margarita V. Zhmykhova, Maxim L. Kuznetsov, Victor N. Khrustalev, Kirill I. Tugashov, Nadezhda A. Bokach, Vadim Yu. Kukushkin|2023|Inorg.Chem.Front.|10|493|doi:10.1039/D2QI02047E
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.cc2c0dyr
title: CCDC 2175144: Experimental Crystal Structure Determination

description: Related Article: Anton V. Rozhkov, Eugene A. Katlenok, Margarita V. Zhmykhova, Maxim L. Kuznetsov, Victor N. Khrustalev, Kirill I. Tugashov, Nadezhda A. Bokach, Vadim Yu. Kukushkin|2023|Inorg.Chem.Front.|10|493|doi:10.1039/D2QI02047E
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.cc2c0dzs
title: CCDC 2175145: Experimental Crystal Structure Determination

description: Related Article: Anton V. Rozhkov, Eugene A. Katlenok, Margarita V. Zhmykhova, Maxim L. Kuznetsov, Victor N. Khrustalev, Kirill I. Tugashov, Nadezhda A. Bokach, Vadim Yu. Kukushkin|2023|Inorg.Chem.Front.|10|493|doi:10.1039/D2QI02047E
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.cc2c28vl
title: CCDC 2176939: Experimental Crystal Structure Determination

description: Related Article: Adesola A. Adeleke, Md. Shahidul Islam, Bernard Omondi|2022|Arch.Pharm.Chem.Life Sci.|356|2200308|doi:10.1002/ardp.202200308
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.cc2c7lmv
title: CCDC 2182047: Experimental Crystal Structure Determination

description: Related Article: Pounraj Thanasekaran, Jui-Hsiang Huang, Cing-Rou Jhou, Hsiang-Chun Tsao, Shruti Mendiratta, Cing-Huei Su, Ching-Ping Liu, Yen-Hsiang Liu, Jui-Hsien Huang, Kuang-Lieh Lu|2022|Dalton Trans.|52|703|doi:10.1039/D2DT03705J
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.cc2c9pgv
title: CCDC 2184057: Experimental Crystal Structure Determination

description: Related Article: Monika, Aniruddha Sarkar, Naiwrit Karmodak, Basab Bijayi Dhar, Sanjay Adhikari|2022|Dalton Trans.|52|540|doi:10.1039/D2DT03242B
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.cc2c9phw
title: CCDC 2184058: Experimental Crystal Structure Determination

description: Related Article: Monika, Aniruddha Sarkar, Naiwrit Karmodak, Basab Bijayi Dhar, Sanjay Adhikari|2022|Dalton Trans.|52|540|doi:10.1039/D2DT03242B
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.cc2c9pjx
title: CCDC 2184059: Experimental Crystal Structure Determination

description: Related Article: Monika, Aniruddha Sarkar, Naiwrit Karmodak, Basab Bijayi Dhar, Sanjay Adhikari|2022|Dalton Trans.|52|540|doi:10.1039/D2DT03242B
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.21912012
title: Raw DATAFINAL.xlsx

description: Raw data
DOI: 10.6084/m9.figshare.21912012.v1
title: Raw DATAFINAL.xlsx

description: Raw data
DOI: 10.26033/hnn0-zg66
title: HST UV Slitless Reflectance Spectra of (1) Ceres Bundle V1.0

description: This archive package contains the reflectance spectra of Ceres from 121 nm to 198 nm based on the slitless spectrographic observations using HST/ACS SBC performed on 2007 November 25. Ceres was spatially resolved to about 21 pixels in diameter. The raw spectra were extracted from the raw 2D spectral image corresponding to all pixels within the disk of Ceres, calibrated to intensity unit and then to reflectance unit. The final reflectance spectra of Ceres is the average of all spectra over the whole disk of Ceres. All intermediate data and the final average reflectance spectra are included in the dataset
DOI: 10.34740/kaggle/dsv/4865194
title: Watson dataset
DOI: 10.34740/kaggle/dsv/4865205
title: Watson dataset
DOI: 10.25919/cjyr-wq59
title: Parkes observations for project P1145 semester 2022OCTS_01

description: Pulsar surveys find pulsars, but follow-up observations are crucial to establish the nature of the pulsars, including their spin-down rate, their magnetic field strength, their polarization properties and whether they are part of a binary system and therefore potentially interesting for further study. We aim to determine timing solutions for 14 pulsars discovered at Parkes but which have not been observed since their discovery.
DOI: 10.25919/cx5q-hb56
title: Parkes observations for project P960 semester 2022OCTS_02

description: We aim to carry out receiver pointing and characterisation tests of Parkes receivers. Typically, these tests are carried out after the receiver package is installed, but time does not always allow for proper characterisation. Receivers for consideration include UWL, MARS and 13MM packages. In addition to cross-referencing C007 for flux calibration via pointing, we aim to conduct gain-elevation and system temperature experiments using the Moon, to ensure users of the Parkes Observatory have the most accurate information available for calibration purposes.
DOI: 10.34740/kaggle/dsv/4865214
title: Watson dataset
DOI: 10.25919/tw8m-2048
title: Parkes pulsar observations with undefined project IDs for 2022OCTS_12

description: Parkes pulsar observations with undefined project IDs for 2022OCTS. This collection contains observations from project IDs PX079, PX095, PX096, PX098 and PX099.
DOI: 10.6073/pasta/ea1dd94e8a5ced8b813e338b32e4ec68
title: Size-fractionated net primary productivity (NPP) estimates based on 13C uptake during cruises along the Northeast U.S. Shelf Long Term Ecological Research (NES-LTER) Transect, ongoing since 2019

description: This dataset consists of primary production measurements based on uptake of carbon-13 added as 13C-bicarbonate during 24-h deckboard incubations of seawater. Sampling occurred on cruises along the Northeast U.S. Shelf Long Term Ecological Research (NES-LTER) Transect during summer, fall, and winter, starting in summer 2019. Net primary production (NPP) was determined from particulate organic carbon (POC) content and associated stable isotope enrichment. Two data tables are included: 1. depth-specific primary productivity based on fractional light levels of the surface irradiance with reference to the profile of photosynthetically active radiation (PAR), and 2. integrated primary productivity. The tables derive from the raw data included as other entities.
DOI: 10.34740/kaggle/dsv/4865234
title: Watson dataset
DOI: 10.34740/kaggle/dsv/4865240
title: Watson dataset
DOI: 10.6084/m9.figshare.21912840
title: Dufour et al. Source Data.xlsx

description: Dataset used to create every graph of the paper "Phenotypic characterization of single CD4+ T cells harboring genetically intact and inducible HIV genomes" in Nature Communications <br> Author list: Caroline Dufour<sup>1</sup>, Corentin Richard<sup>1</sup>, Marion Pardons<sup>1</sup>, Marta Massanella<sup>1</sup>, Antoine Ackaoui<sup>1</sup>, Ben Murrell<sup>2</sup>, Bertrand Routy<sup>1</sup>, Réjean Thomas<sup>3</sup>, Jean-Pierre Routy<sup>4</sup>, Rémi Fromentin<sup>1</sup>, Nicolas Chomont<sup>1</sup> <br> <sup>1</sup>Centre de Recherche du CHUM and Department of Microbiology, Infectiology and Immunology, Université de Montréal, Montreal, H2X 0A9, Quebec, Canada <sup>2</sup>Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, 171 77, Sweden <sup>3</sup>Clinique médicale l’Actuel, Montreal, H2L 4P9, Quebec, Canada <sup>4</sup>Division of Hematology & Chronic Viral Illness Service, McGill University Heath Centre, Montreal, H4A 3J1, Quebec, Canada
DOI: 10.6084/m9.figshare.21912840.v2
title: Dufour et al. Source Data.xlsx

description: Dataset used to create every graph of the paper "Phenotypic characterization of single CD4+ T cells harboring genetically intact and inducible HIV genomes" in Nature Communications <br> Author list: Caroline Dufour<sup>1</sup>, Corentin Richard<sup>1</sup>, Marion Pardons<sup>1</sup>, Marta Massanella<sup>1</sup>, Antoine Ackaoui<sup>1</sup>, Ben Murrell<sup>2</sup>, Bertrand Routy<sup>1</sup>, Réjean Thomas<sup>3</sup>, Jean-Pierre Routy<sup>4</sup>, Rémi Fromentin<sup>1</sup>, Nicolas Chomont<sup>1</sup> <br> <sup>1</sup>Centre de Recherche du CHUM and Department of Microbiology, Infectiology and Immunology, Université de Montréal, Montreal, H2X 0A9, Quebec, Canada <sup>2</sup>Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, 171 77, Sweden <sup>3</sup>Clinique médicale l’Actuel, Montreal, H2L 4P9, Quebec, Canada <sup>4</sup>Division of Hematology & Chronic Viral Illness Service, McGill University Heath Centre, Montreal, H4A 3J1, Quebec, Canada
DOI: 10.6084/m9.figshare.21912840.v1
title: Dufour et al. Source Data.xlsx

description: Dataset used to create every graph of the paper "Phenotypic characterization of single CD4+ T cells harboring genetically intact and inducible HIV genomes" in Nature Communications <br> Author list: Caroline Dufour<sup>1</sup>, Corentin Richard<sup>1</sup>, Marion Pardons<sup>1</sup>, Marta Massanella<sup>1</sup>, Antoine Ackaoui<sup>1</sup>, Ben Murrell<sup>2</sup>, Bertrand Routy<sup>1</sup>, Réjean Thomas<sup>3</sup>, Jean-Pierre Routy<sup>4</sup>, Rémi Fromentin<sup>1</sup>, Nicolas Chomont<sup>1</sup> <br> <sup>1</sup>Centre de Recherche du CHUM and Department of Microbiology, Infectiology and Immunology, Université de Montréal, Montreal, H2X 0A9, Quebec, Canada <sup>2</sup>Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, 171 77, Sweden <sup>3</sup>Clinique médicale l’Actuel, Montreal, H2L 4P9, Quebec, Canada <sup>4</sup>Division of Hematology & Chronic Viral Illness Service, McGill University Heath Centre, Montreal, H4A 3J1, Quebec, Canada
DOI: 10.6084/m9.figshare.21912903
title: Genome files of Gemella haemolysans PGMMGM001

description: <br> PGMMGM001.faa is the protein FASTA file of the translated CDS sequences. <br> PGMMGM001.ffn is the nucleotide FASTA file of all the prediction transcripts (CDS, rRNA, tRNA, tmRNA, misc_RNA). <br> PGMMGM001.fna is the nucleotide FASTA file of the input contig sequences. <br> PGMMGM001.gbk is a standard Genbank file derived from the master .gff. If the input to prokka was a multi-FASTA, then this will be a multi-Genbank, with one record for each sequence. <br> PGMMGM001.gff is the master annotation in GFF3 format, containing both sequences and annotations. It can be viewed directly in Artemis or IGV. <br> PGMMGM001.tsv is the tab-separated file of all features: locus_tag,ftype,len_bp,gene,EC_number,COG,product.
DOI: 10.25919/s8jr-d111
title: Parkes observations for project P1129 semester 2022OCTS_02

description: PSR J0837$-$2454 is a young, high-Galactic-latitude pulsar, whose distance derived from dispersion measure (DM) implies a height of $&gt;$1~kpc above the Galactic plane. The young age (28kyr) and position can be explained if (i) the pulsar was born at this high Galactic $z$-height from a runaway or walkaway O/B star; or (ii) the DM-derived distance to this pulsar is incorrect and the pulsar is closer to the plane of the Galaxy. VLBA observations will provide us with an estimate of the proper motion of the pulsar, along with the distance to the pulsar through a measurement of the parallax if the pulsar is closer than the DM implies. These measurements are crucial to determining whether or not this pulsar represents the remnants of a rare Milky Way halo O/B star. This proposal seeks to continue monitoring this pulsar in order to maintain phase connection of the timing solution throughout the duration of planned VLBA observations. This is crucial for conducting gated observations with the VLBA, but will also contribute to studies of the pulsar's emission properties and the ISM along the line-of-sight to the pulsar.
DOI: 10.25919/9m76-w584
title: Parkes observations for project P1050 semester 2022OCTS_09

description: This is a request for the observation time for the timing campaign of new pulsars discovered in the reprocessing of the low-latitude Galactic plane section of the HTRU-S survey (HTRU-S LowLat) and the Parkes Multibeam Pulsar Survey (PMPS). We have completed 90 % of the HTRU-S LowLat survey and completed zero acceleration PMPS search with GPU-based coherent acceleration search, template bank, and fast folding algorithm pipelines and now have discovered 115 previously unknown pulsars among which 20 were found in the PMPS. Interesting science can usually only be derived from a new pulsar after confirmation, and a follow-up timing campaign is carried out. At least one year of initial timing is the minimum timespan required to fully characterise any newly-discovered pulsars, essential for deriving pulsar parameters such as the characteristic age, magnetic field strength, and spin-down rate, as well as for detecting any unexpected behaviour of the pulsar which might result from emission instabilities. This project is necessary for the timing of several interesting pulsars, including binary pulsars, high DM pulsars, scattered profile pulsars, and bright ones that show emissions in larger bandwidths in the UWL band. The follow-up timing in OCTS22 will assist in completing many exciting large-term science goals. In addition, the data obtained from this timing project will allow us to obtain many auxiliary scientific results which would help us understand the nature of the interstellar medium, spectral properties as well as pulsar emission mechanism.
DOI: 10.6084/m9.figshare.21890511.v3
title: Zhang-Rice singlets state formed by two-step oxidation for triggering water oxidation under operando conditions

description: Zhang-Rice singlets state formed by two-step oxidation for triggering water oxidation under <em>operando</em> conditions
DOI: 10.5281/zenodo.7541827
title: Supplemental Data 4

description: file contains link for download Download contains KG, embeddings, uniprot2genename, and reactome2pathwayname files <code>data/GP2VEC_emb_walk_file_40_40_0_0_bwV4_s256_w7_n5_mc5.txt</code>: embedding KG file <code>data/GP2VEC_emb_walk_file_40_40_0_0_bwV4_s256_w7_n5_mc5</code>: embedding KG file <code>data/df_edges.csv</code>: main KG edge file <code>data/df_node.csv</code>: KG node file <code>data/df_relation.csv</code>: KG relation type file <code>data/df_type.csv</code>: KG node type file <code>data/original/GeneNameMapping.txt</code>: UniProtID to name mapping file. One of the input files for GeneratingKinaseGraph <code>data/original/ReactomePathways.txt</code>: ReactomeID to name mapping file. One of the input files for GeneratingKianseGraph
description: For publications