cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for infrared absorption spectroscopy (IR)
 
 IR (ATR, ṽ) = 2972 (m), 2931 (w), 2867 (w), 2834 (w), 2759 (w), 2718 (w), 2489 (w), 1737 (vw), 1703 (vw), 1599 (w), 1587 (w), 1543 (vw), 1517 (m), 1496 (w), 1466 (s), 1456 (s), 1422 (vs), 1400 (vs), 1380 (s), 1361 (vs), 1323 (s), 1241 (vs), 1205 (s), 1184 (m), 1152 (vs), 1128 (s), 1101 (s), 1077 (m), 1055 (s), 1031 (vs), 1006 (m), 990 (m), 977 (m), 956 (m), 907 (m), 877 (w), 830 (m), 806 (w), 754 (vs), 730 (vs), 704 (vs), 626 (m), 615 (m), 586 (m), 575 (m), 555 (m), 523 (m), 510 (s), 472 (m), 458 (m), 436 (w), 424 (w), 415 (w), 401 (w), 390 (m), 375 (w) cm–1.
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000599
title: correlation spectroscopy (COSY) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for correlation spectroscopy (COSY)
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000596.1
title: distortionless enhancement with polarization transfer (DEPT) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for distortionless enhancement with polarization transfer (DEPT)
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 13C NMR (100 MHz, Chloroform-d [77.0 ppm], ppm) δ = 162.2 (Cq), 136.8 (Cq), 130.0 (CH), 128.7 (CH, 2C), 127.8 (CH, 3C), 93.8 (CH), 56.0 (CH2), 48.6 (CH), 45.5 (CH), 23.9 (CH3, 2C), 19.3 (CH3, 2C).
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000596.1
title: distortionless enhancement with polarization transfer (DEPT) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for distortionless enhancement with polarization transfer (DEPT)
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000599
title: correlation spectroscopy (COSY) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for correlation spectroscopy (COSY)
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n.1
title: (E)-1-benzyl-5-(3,3-diisopropyltriaz-1-en-1-yl)-1H-pyrazole
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+, and canonical SMILES descriptor[cheminf_000007]: CC(N(C(C)C)/N=N/c1ccnn1Cc1ccccc1)C, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-23345

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 49.4 - 50.5 (°C)
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 CHMO:0000596 | distortionless enhancement with polarization transfer (DEPT)
 
 CHMO:0000596 | distortionless enhancement with polarization transfer (DEPT)
 
 CHMO:0000604 | heteronuclear single quantum coherence (HSQC)
 
 CHMO:0000601 | heteronuclear multiple bond coherence (HMBC)
 
 CHMO:0000599 | correlation spectroscopy (COSY)
 
 CHMO:0000470 | mass spectrometry (MS)
 
 CHMO:0000630 | infrared absorption spectroscopy (IR)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000596
title: distortionless enhancement with polarization transfer (DEPT) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for distortionless enhancement with polarization transfer (DEPT)
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 13C NMR (100 MHz, Chloroform-d [77.0 ppm], ppm) δ = 151.6 (Cq), 138.9 (CH), 137.9 (Cq), 128.4 (CH, 2C), 127.6 (CH, 2C), 127.2 (CH), 90.3 (CH), 51.6 (CH2), 49.8 (CH), 46.8 (CH), 23.6 (CH3, 2C), 19.0 (CH3, 2C).
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 1H NMR (400 MHz, Chloroform-d [7.27 ppm], ppm) δ = 7.35–7.26 (m, 5H), 7.23 (d, J = 2.4 Hz, 1H), 6.25 (d, J = 2.4 Hz, 1H), 5.40 (ps, 1H), 5.26 (s, 2H), 3.96 (ps, 1H), 1.36–1.22 (m, 12H).
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000601
title: heteronuclear multiple bond coherence (HMBC) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for heteronuclear multiple bond coherence (HMBC)
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000596
title: distortionless enhancement with polarization transfer (DEPT) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for distortionless enhancement with polarization transfer (DEPT)
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n.1
title: (E)-1-benzyl-3-(3,3-diisopropyltriaz-1-en-1-yl)-1H-pyrazole
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+, and canonical SMILES descriptor[cheminf_000007]: CC(N(C(C)C)/N=N/c1ccn(n1)Cc1ccccc1)C, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-23335

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 CHMO:0000596 | distortionless enhancement with polarization transfer (DEPT)
 
 CHMO:0000596 | distortionless enhancement with polarization transfer (DEPT)
 
 CHMO:0000604 | heteronuclear single quantum coherence (HSQC)
 
 CHMO:0000601 | heteronuclear multiple bond coherence (HMBC)
 
 CHMO:0000599 | correlation spectroscopy (COSY)
 
 CHMO:0000470 | mass spectrometry (MS)
 
 CHMO:0000630 | infrared absorption spectroscopy (IR)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for mass spectrometry (MS)
 
 MS (EI, 70 eV, 60 °C), m/z (%): 285 (17) [M]+, 185 (57), 158 (24), 130 (15), 104 (17), 100 (11), 91 (100), 86 (10), 77 (19), 65 (19).HRMS–EI (C16H23N5) (m/z): [M]+ Calcd 285.1948; Found 285.1950.
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000604
title: heteronuclear single quantum coherence (HSQC) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for heteronuclear single quantum coherence (HSQC)
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000601
title: heteronuclear multiple bond coherence (HMBC) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for heteronuclear multiple bond coherence (HMBC)
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 1H NMR (400 MHz, Chloroform-d [7.27 ppm], ppm) δ = 7.42 (d, J = 2.0 Hz, 1H), 7.31–7.20 (m, 5H), 6.09 (d, J = 2.1 Hz, 1H), 5.44 (s, 2H), 5.06 (sept, J = 6.8 Hz, 1H), 4.00 (sept, J = 6.7 Hz, 1H), 1.34 (d, J = 6.0 Hz, 6H), 1.22 (d, J = 6.2 Hz, 6H).
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for mass spectrometry (MS)
 
 MS (EI, 70 eV, 60 °C), m/z (%): 285 (100) [M]+, 185 (98), 157 (19), 130 (33), 128 (12), 104 (23), 100 (43), 91 (80), 77 (14), 58 (32).HRMS–EI (C16H23N5) (m/z): [M]+ Calcd 285.1948; Found 285.1949.
DOI: 10.14272/zidruqycdswwjm-vhebqxmusa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-18-16-10-11-17-20(16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-18+

description: dataset for infrared absorption spectroscopy (IR)
 
 IR (ATR, ṽ) = 3089 (w), 2975 (m), 2955 (w), 2946 (w), 2932 (w), 2866 (w), 1519 (w), 1511 (w), 1497 (w), 1477 (w), 1468 (w), 1455 (w), 1412 (vs), 1381 (s), 1361 (vs), 1329 (m), 1317 (w), 1303 (w), 1258 (vs), 1218 (vs), 1207 (s), 1154 (s), 1130 (m), 1123 (m), 1102 (vs), 1069 (w), 1043 (s), 1021 (vs), 976 (w), 935 (w), 924 (s), 905 (m), 880 (w), 864 (m), 847 (w), 824 (w), 815 (w), 783 (w), 764 (vs), 722 (vs), 711 (vs), 697 (s), 686 (w), 649 (w), 620 (w), 589 (vs), 575 (m), 555 (s), 531 (s), 504 (w), 473 (w), 462 (w), 442 (w), 424 (w), 409 (w), 377 (w) cm–1.
DOI: 10.14272/mgavnyxvfxwssz-htxnqapbsa-n/chmo0000604
title: heteronuclear single quantum coherence (HSQC) ()
title: InChI=1S/C16H23N5/c1-13(2)21(14(3)4)19-17-16-10-11-20(18-16)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3/b19-17+

description: dataset for heteronuclear single quantum coherence (HSQC)
DOI: 10.6084/m9.figshare.8082005
title: Chlorogenic acid relieved oxidative stress injury in retinal ganglion cells through IncRNA-TUG1/Nrf2

description: <b>Objective</b>: To discover the possible underlying mechanism of Chlorogenic acid (CGA) in protecting against oxidative stress injury in glaucoma. <b>Methods</b>: LncRNA TUG1 and Nrf2 expressions were detected by qRT-PCR and Western blot. Retinal ganglion cell (RGC) viability and apoptosis were measured by MTT and flow cytometry, respectively. Reactive oxygen species (ROS) level was determined by reactive oxygen species assay kit. The interaction between lncRNA TUG1 and Nrf2 was confirmed by RNA pull-down and RIP assay. <b>Results</b>: IPL thickness and lncRNA TUG1 expression were significantly decreased in glaucoma mice model, and CGA treatment increased IPL thickness and lncRNA TUG1 expression. <i>In vitro</i> H2O2-induced RGCs, RGC viability was significantly decreased, and ROS level and cell apoptosis were significantly increased. CGA up-regulated lncRNA TUG1 and Nrf2 expressions, decreased cell apoptosis and ROS production in RGCs, and increased RGCs viability. We further verified the interaction between lncRNA TUG1 and Nrf2, and proved Nrf2 was positively regulated by lncRNA TUG1. We found CGA promoted Nrf2 expression through lncRNA-TUG1, and further verified CGA protected RGCs from oxidative stress through regulating lncRNA TUG1/Nrf2. <i>In vivo</i> experiments showed TUG1 knockdown abrogated therapeutic effect of CGA on glaucoma. <b>Conclusion</b>: CGA increased RGC viability and decreased ROS level and RGC apoptosis after oxidative stress injury through lncRNA TUG1/Nrf2 pathway, which protected against glaucoma.
DOI: 10.6084/m9.figshare.8082005.v2
title: Chlorogenic acid relieved oxidative stress injury in retinal ganglion cells through IncRNA-TUG1/Nrf2

description: <b>Objective</b>: To discover the possible underlying mechanism of Chlorogenic acid (CGA) in protecting against oxidative stress injury in glaucoma. <b>Methods</b>: LncRNA TUG1 and Nrf2 expressions were detected by qRT-PCR and Western blot. Retinal ganglion cell (RGC) viability and apoptosis were measured by MTT and flow cytometry, respectively. Reactive oxygen species (ROS) level was determined by reactive oxygen species assay kit. The interaction between lncRNA TUG1 and Nrf2 was confirmed by RNA pull-down and RIP assay. <b>Results</b>: IPL thickness and lncRNA TUG1 expression were significantly decreased in glaucoma mice model, and CGA treatment increased IPL thickness and lncRNA TUG1 expression. <i>In vitro</i> H2O2-induced RGCs, RGC viability was significantly decreased, and ROS level and cell apoptosis were significantly increased. CGA up-regulated lncRNA TUG1 and Nrf2 expressions, decreased cell apoptosis and ROS production in RGCs, and increased RGCs viability. We further verified the interaction between lncRNA TUG1 and Nrf2, and proved Nrf2 was positively regulated by lncRNA TUG1. We found CGA promoted Nrf2 expression through lncRNA-TUG1, and further verified CGA protected RGCs from oxidative stress through regulating lncRNA TUG1/Nrf2. <i>In vivo</i> experiments showed TUG1 knockdown abrogated therapeutic effect of CGA on glaucoma. <b>Conclusion</b>: CGA increased RGC viability and decreased ROS level and RGC apoptosis after oxidative stress injury through lncRNA TUG1/Nrf2 pathway, which protected against glaucoma.
DOI: 10.6084/m9.figshare.14372045.v1
title: New ribotype <i>Clostridioides difficile</i> from ST11 group revealed higher pathogenic ability than RT078

description: <i>Clostridioides difficile</i> is the predominant antibiotic-associated enteropathogen associated with diarrhoea or pseudomembranous colitis in patients worldwide. Previously, we identified <i>C. difficile</i> RT078 isolates (CD21062) from elderly patients in China, including two new ribotype strains (CD10010 and CD12038) belonging to the ST11 group, and their genomic features were also investigated. This study compared sporulation, spore germination, toxin expression, flagellar characteristics, and adhesion among these strains in vitro and analysed their pathogenic ability in vivo using animal models. The results showed sporulation and spore germination did not significantly differ among the three <i>C. difficile</i> strains. CD10010 and CD12038 showed higher transcriptional levels of toxins until 48 h; thereafter, the transcriptional levels of toxins remained constant among RT078, CD10010, and CD12038. RT078 showed a loss of flagellum and its related genes, whereas CD12038 showed the highest motility in vitro. Both CD10010 and CD12038 initially showed <i>flg</i> phase OFF, and the flagellar switch reversed to phase ON after 48 h in swim agar. Flagellar proteins and toxins were both upregulated when <i>flg</i> phase OFF changed to <i>flg</i> phase ON status, enhancing their pathogenic ability. CD12038 showed the highest adhesion to Hep-2 cells. Histopathology and inflammation scores demonstrated that CD12038 caused the most severe tissue damage and infection in vivo. The new ribotype strains, particularly CD12038, exhibit higher pathogenic ability than the typical RT078 strain, both in vitro and in vivo. Therefore, more attention should be paid to this new <i>C. difficile</i> strain in epidemiological research; further studies are warranted.
DOI: 10.6084/m9.figshare.21185687
title: Additional file 8 of Malignant clonal evolution drives multiple myeloma cellular ecological diversity and microenvironment reprogramming

description: Additional file 8: Supplementary Table 3. Specific marker genes of control donor BM cells. BM, bone marrow.
DOI: 10.34740/kaggle/dsv/4748246
title: Worldwide Internet users as % of populationti
DOI: 10.34740/kaggle/dsv/4748367
title: Elon Musk Tweets
DOI: 10.5281/zenodo.7446594
title: Neutron Bragg edge imaging for strain characterization in powder bed additive manufacturing environments

description: The paper describes an approach to disentangle the recorded transmission spectrum obtained from Bragg edge imaging. The transmission spectrum of the samples embedded in their corresponding powder was successfully extracted, proven by the coinciding strain maps produced. The horizontal profiles from the maps were plotted together with neutron diffraction results and they agree very well. The uploaded data were the raw data obtained from Bragg edge imaging and neutron diffraction experiments used to construct the strain maps and plots shown in the paper.
DOI: 10.5281/zenodo.7446593
title: Neutron Bragg edge imaging for strain characterization in powder bed additive manufacturing environments

description: The paper describes an approach to disentangle the recorded transmission spectrum obtained from Bragg edge imaging. The transmission spectrum of the samples embedded in their corresponding powder was successfully extracted, proven by the coinciding strain maps produced. The horizontal profiles from the maps were plotted together with neutron diffraction results and they agree very well. The uploaded data were the raw data obtained from Bragg edge imaging and neutron diffraction experiments used to construct the strain maps and plots shown in the paper.
DOI: 10.15151/esrf-dc-1026409781
title: Advanced Models of Biological Membranes with Hydrogenous and Deuterated Natural Glycerophospholipid Mixtures

description: Cellular membranes are complex systems that consist of hundreds of different lipid species. Their investigation often relies on simpler model systems including few synthetic lipid species. Glycerophospholipids (GPLs) extracted from cells are a valuable resource to produce advanced models of biological membranes. Here, we present the optimisation of a method previously reported by our team for the extraction and purification of various GPL mixtures from Pichia pastoris. The implementation of an additional purification step by High Performance Liquid Chromatography-Evaporative Light Scattering Detec- tor (HPLC-ELSD) enabled a better separation of the GPL mixtures from the neutral lipid fraction that includes sterols, and also allowed for the GPLs to be purified according to their different polar headgroups. For this study, we produced and employed phoshatidyl- choline (PC), phosphatidylserine (PS) and phosphatidylglycerol (PG) mixtures. These exhibit a single composition of the polar head, i.e., PC, PS or PG, but contain several molecular species consisting of acyl chains of varying length and unsaturation, which were determined by Gas Chromatography (GC). The lipid mixtures were produced both in their hydrogenous (H) and deuterated (D) versions and were used to form lipid bi- layers both on solid substrates and as vesicles in solution. The supported lipid bilayers were characterised by quartz crystal microbalance with dissipation monitoring (QCM-D) and neutron reflectometry (NR), whereas the vesicles by small angle X-ray (SAXS) and neutron scattering (SANS). Our results show that despite differences in the acyl chain composition, the hydrogenous and deuterated extracts produced bilayers with very com- parable structures, which makes them valuable to design experiments involving selective deuteration with techniques such as NMR, neutron scattering or infrared spectroscopy.
DOI: 10.22008/fk2/ih3jas
title: COSMO SkyMed Ice Velocity, Upernavik 2014

description: Ice velocities derived from COSMO-SkyMed campaign over Upernavik in 2014
DOI: 10.22008/fk2/ih3jas/4jsfp9
title: UPE_COSMO_IV_NCF3.nc

description: All generated ice velocity maps
DOI: 10.5517/ccdc.csd.cc27fg38
title: CCDC 2068509: Experimental Crystal Structure Determination

description: Related Article: Martin Piesch, Stephan Reichl, Michael Seidl, Gábor Balázs, Manfred Scheer|2021|Angew.Chem.,Int.Ed.|60|15101|doi:10.1002/anie.202103683
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.cc27fg5b
title: CCDC 2068511: Experimental Crystal Structure Determination

description: Related Article: Martin Piesch, Stephan Reichl, Michael Seidl, Gábor Balázs, Manfred Scheer|2021|Angew.Chem.,Int.Ed.|60|15101|doi:10.1002/anie.202103683
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.cc27fg9g
title: CCDC 2068515: Experimental Crystal Structure Determination

description: Related Article: Martin Piesch, Stephan Reichl, Michael Seidl, Gábor Balázs, Manfred Scheer|2021|Angew.Chem.,Int.Ed.|60|15101|doi:10.1002/anie.202103683
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.