cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.6084/m9.figshare.21908653
title: Pre-Born–Oppenheimer energies, leading-order relativistic and QED corrections for electronically excited states of molecular hydrogen

description: For rovibronic states corresponding to the <i>B</i> and B′1Σu+ electronic states of the hydrogen molecule, the pre-Born–Oppenheimer (four-particle) non-relativistic energy is converged to a 1–3 parts-per-billion relative precision. The four-particle non-relativistic energy is appended with leading-order relativistic, leading- and estimated higher-order quantum-electrodynamics corrections. The resulting term values referenced to the rovibronic ground state are obtained in an excellent agreement with the experimental results. Further results are reported and discussed for other rovibronic states assignable to the C1Πu and the EF,GK, and HH1Σg+ electronic states.
DOI: 10.6084/m9.figshare.23064583
title: High-precision Ramsey-comb spectroscopy on molecular deuterium for tests of molecular quantum theory

description: Precision spectroscopy of simple, calculable molecules has become an important tool to compare experiments with theory in an effort to test our understanding of the fundamental laws of physics. For this purpose, we have measured the EF1Σg+(v′=0,N′=0)←X1Σg+(v″=0,N″=0) transition frequency of molecular deuterium (D2) with unprecedented accuracy. We use Ramsey-Comb spectroscopy at deep-ultraviolet wavelengths (201 nm) with a two-photon, Doppler-free interrogation scheme. The resulting transition frequency is f=2,981,779,227,578(19) kHz. The 1-<i>σ</i> uncertainty of 19 kHz represents an improvement of more than two orders of magnitude compared to the best previous measurement. In this paper, we give an extensive description of our methods and the experimental apparatus that we employed. Particular attention is given to aspects that we recently improved, such as the frequency comb laser system, the method of signal recording, and the cryogenic D2 molecular beam apparatus. In combination with future measurements of the ionisation energy of the EF state, our measurement paves the way for an improved determination of the ground state ionisation and dissociation energy of molecular deuterium.
DOI: 10.6084/m9.figshare.23064583.v1
title: High-precision Ramsey-comb spectroscopy on molecular deuterium for tests of molecular quantum theory

description: Precision spectroscopy of simple, calculable molecules has become an important tool to compare experiments with theory in an effort to test our understanding of the fundamental laws of physics. For this purpose, we have measured the EF1Σg+(v′=0,N′=0)←X1Σg+(v″=0,N″=0) transition frequency of molecular deuterium (D2) with unprecedented accuracy. We use Ramsey-Comb spectroscopy at deep-ultraviolet wavelengths (201 nm) with a two-photon, Doppler-free interrogation scheme. The resulting transition frequency is f=2,981,779,227,578(19) kHz. The 1-<i>σ</i> uncertainty of 19 kHz represents an improvement of more than two orders of magnitude compared to the best previous measurement. In this paper, we give an extensive description of our methods and the experimental apparatus that we employed. Particular attention is given to aspects that we recently improved, such as the frequency comb laser system, the method of signal recording, and the cryogenic D2 molecular beam apparatus. In combination with future measurements of the ionisation energy of the EF state, our measurement paves the way for an improved determination of the ground state ionisation and dissociation energy of molecular deuterium.
DOI: 10.6084/m9.figshare.21908653.v1
title: Pre-Born–Oppenheimer energies, leading-order relativistic and QED corrections for electronically excited states of molecular hydrogen

description: For rovibronic states corresponding to the <i>B</i> and B′1Σu+ electronic states of the hydrogen molecule, the pre-Born–Oppenheimer (four-particle) non-relativistic energy is converged to a 1–3 parts-per-billion relative precision. The four-particle non-relativistic energy is appended with leading-order relativistic, leading- and estimated higher-order quantum-electrodynamics corrections. The resulting term values referenced to the rovibronic ground state are obtained in an excellent agreement with the experimental results. Further results are reported and discussed for other rovibronic states assignable to the C1Πu and the EF,GK, and HH1Σg+ electronic states.
DOI: 10.6084/m9.figshare.14823039
title: Physicochemical data, microbial abundance data, and programming scripts

description: Dataset for manuscript titled "Microbial Community Biomarkers Can Forecast Future Methane Production in Full-scale Anaerobic digesters" by Cokro et al. <br>Physicochemical and microbial abundance data collected from 3 full-scale digesters in a wastewater treatment plant in Singapore. Selected parameters were used in the development of methane production prediction model<br>Scripts used in the study are also included
DOI: 10.13140/rg.2.2.22633.47207
title: Official programme of the X. Tagung für Praktische Philosophie, University of Salzburg, 28-29 September 2023. I shall participate in the Conference with a lecture whose title is "Aspekte des Bösen bei Platon"
DOI: 10.13026/dxqa-pb41
title: Heart Murmur Detection from Phonocardiogram Recordings: The George B. Moody PhysioNet Challenge 2022

description: Congenital heart diseases affect about 1% of newborns, representing an
important morbidity and mortality factor for several severe conditions,
including advanced heart failure [[1](https://moody-
challenge.physionet.org/2022/#Burstein19)]. In a 2019 survey, it was estimated
that congenital heart diseases affect over 500,000 children in East Africa
[[2](https://moody-challenge.physionet.org/2022/#Jivanji19)], and about 8 in
every 1000 live births [[3](https://moody-
challenge.physionet.org/2022/#Zuhlke13)]. Acquired heart diseases include
rheumatic fever and the Kawasaki disease, the former being a serious public
health problem in developing regions, e.g., rural Brazil [[4](https://moody-
challenge.physionet.org/2022/#Carvalho12)]. Several regions of developing
countries have difficulties in diagnosing and treating both congenital and
acquired heart conditions in children. This is mainly due to the lack of
infrastructure and cardiology specialists in geographically large areas and
difficulty in accessing health services. In addition, the current COVID-19
pandemic poses new difficulties in the clinical evaluation of patients by
delaying important in-person patient-doctor contacts, negatively impacting
screening and monitoring activities.

A non-invasive assessment of the mechanical function of the heart, performed
at point-of-care settings, can provide early information regarding congenital
and acquired heart diseases in children. The lack of early diagnoses of these
conditions represents a major public health problem, especially in
underprivileged countries with high birth rates [[5](https://moody-
challenge.physionet.org/2022/#Tandon10), [6](https://moody-
challenge.physionet.org/2022/#Seckeler11), [7](https://moody-
challenge.physionet.org/2022/#Gheorghe18)]. In particular, cardiac
auscultation and the analysis of the phonocardiogram (PCG) can unveil
fundamental clinical information regarding heart malfunctioning caused by
congenital and acquired heart disease in pediatric populations. This is
achieved by detecting abnormal sound waves, or heart murmurs, in the PCG
signal. Murmurs are abnormal waves generated by turbulent blood flow in
cardiac and vascular structures. They are closely associated with specific
diseases such as septal defects, failure of ductus arteriosus closure in
newborns, and defective cardiac valves.

Succedent the [2016 Challenge](/content/challenge-2016/), which focused on
classifying normal vs. abnormal heart sounds from a single short recording
from a single precordial location [[8](https://moody-
challenge.physionet.org/2022/#Clifford16), [9](https://moody-
challenge.physionet.org/2022/#Clifford17)], this year's Challenge is devoted
to detecting the presence or absence of murmurs from multiple heart sound
recordings from multiple auscultation locations, as well as detecting the
clinical outcomes.
DOI: 10.13026/t49p-5v35
title: Heart Murmur Detection from Phonocardiogram Recordings: The George B. Moody PhysioNet Challenge 2022

description: Congenital heart diseases affect about 1% of newborns, representing an
important morbidity and mortality factor for several severe conditions,
including advanced heart failure [[1](https://moody-
challenge.physionet.org/2022/#Burstein19)]. In a 2019 survey, it was estimated
that congenital heart diseases affect over 500,000 children in East Africa
[[2](https://moody-challenge.physionet.org/2022/#Jivanji19)], and about 8 in
every 1000 live births [[3](https://moody-
challenge.physionet.org/2022/#Zuhlke13)]. Acquired heart diseases include
rheumatic fever and the Kawasaki disease, the former being a serious public
health problem in developing regions, e.g., rural Brazil [[4](https://moody-
challenge.physionet.org/2022/#Carvalho12)]. Several regions of developing
countries have difficulties in diagnosing and treating both congenital and
acquired heart conditions in children. This is mainly due to the lack of
infrastructure and cardiology specialists in geographically large areas and
difficulty in accessing health services. In addition, the current COVID-19
pandemic poses new difficulties in the clinical evaluation of patients by
delaying important in-person patient-doctor contacts, negatively impacting
screening and monitoring activities.

A non-invasive assessment of the mechanical function of the heart, performed
at point-of-care settings, can provide early information regarding congenital
and acquired heart diseases in children. The lack of early diagnoses of these
conditions represents a major public health problem, especially in
underprivileged countries with high birth rates [[5](https://moody-
challenge.physionet.org/2022/#Tandon10), [6](https://moody-
challenge.physionet.org/2022/#Seckeler11), [7](https://moody-
challenge.physionet.org/2022/#Gheorghe18)]. In particular, cardiac
auscultation and the analysis of the phonocardiogram (PCG) can unveil
fundamental clinical information regarding heart malfunctioning caused by
congenital and acquired heart disease in pediatric populations. This is
achieved by detecting abnormal sound waves, or heart murmurs, in the PCG
signal. Murmurs are abnormal waves generated by turbulent blood flow in
cardiac and vascular structures. They are closely associated with specific
diseases such as septal defects, failure of ductus arteriosus closure in
newborns, and defective cardiac valves.

Succedent the [2016 Challenge](/content/challenge-2016/), which focused on
classifying normal vs. abnormal heart sounds from a single short recording
from a single precordial location [[8](https://moody-
challenge.physionet.org/2022/#Clifford16), [9](https://moody-
challenge.physionet.org/2022/#Clifford17)], this year's Challenge is devoted
to detecting the presence or absence of murmurs from multiple heart sound
recordings from multiple auscultation locations, as well as detecting the
clinical outcomes.
DOI: 10.13140/rg.2.2.10469.99044
title: Official programme of the X. Tagung für Praktische Philosophie, University of Salzburg, 28-29 September 2023. I shall participate in the Conference with a lecture whose title is "Aspekte des Bösen bei Platon"
DOI: 10.5519/qd.o9230h9l
title: Query on the Natural History Museum Data Portal (data.nhm.ac.uk) (21 records)
DOI: 10.18112/openneuro.ds004776.v1.0.0
title: Infant FreeSurfer test subject (CNYBCH)
DOI: 10.11588/data/avff2e/obi0po
title: paper_sbi.tar.gz

description: :unav
DOI: 10.11588/data/avff2e/zav9pp
title: README.md

description: :unav
DOI: 10.11588/data/d7mize/t2ojck
title: 1_furthersites_north.pdf
DOI: 10.11588/data/d7mize/4wivs1
title: 1-1_annan_zhongdian-guxue_derong.pdf
DOI: 10.11588/data/d7mize/bvtk1a
title: 5-13_baidamo-laochang_xinping_2018.pdf
DOI: 10.11588/data/d7mize/n6pyjy
title: 3-3_wushantou-songgui-xiyi.kmz
DOI: 10.11588/data/d7mize/trqgy8
title: 8-8_ban-thi_bac-kan_2017.pdf
DOI: 10.11588/data/d7mize/i2bita
title: 2-10_nashigang_xundian_2020.pdf
DOI: 10.11588/data/d7mize/6wwepk
title: 3_furthersites_yongping.kmz
DOI: 10.11588/data/d7mize/dxv3js
title: 5-5b_puzhangshan_chuxiong.kmz
DOI: 10.5281/zenodo.8387655
title: CoBaHMA domains: supplementary Table and Data

description: Supplementary Table and Supplementary Data 1 to 4 to the article "<strong>AlphaFold2-guided description of CoBaHMA, a novel family of bacterial domains within the Heavy-Metal Associated superfamily"</strong> <strong>Supplementary Table 1 </strong>(.xlsx file): <strong>Structural and functional annotations of the large communities of CobaHMA domain proteins.</strong> The number of community sequences matching a given profile (IPR or ECOD) is indicated. The color code corresponds to the following functional categories. For each IPR accession, the type of profile is indicated between brackets (D for domain, F for family, H for superfamily). <strong>Structural and functional annotations of small communities.</strong> Only the 20 small communities with at least one new annotation (e.g. not shared with the large communities, in grey and black) are detailed here. For these 20 communities, some annotations are shared with the large communities, corresponding only to P-type (cyan) and HMA (yellow). For a complete view of the annotations of the small communties, see <strong>Supplementary Figure 5</strong>. The number of community sequences matching a given profile (IPR or ECOD) is indicated. For each IPR accession, the type of profile is indicated between brackets (D for domain, F for family, H for superfamily). <strong>Supplementary Data 1 </strong>(.zip file): Multiple sequence alignments (MSA) of the sequences of the most populated communities, build using MAFFT and rendered using EspPript3. The first two lines report the 2D structures of the AF2 model of the representative sequence of the community, and its amino acid sequence. The initial MSA (fasta format) is also provided, together with the coordinates of the 3D structure model (pdb format) and the HCA plot (postcript file) of the representative sequence of the considered community. <strong>Supplementary Data 2 </strong>(.zip file): Annotations by communities: Modular organization of the full-length CoBaHMA domain proteins within the 48 large community (Functional annotations are indicated along the sequence by shaded areas. Each functional category of domain is highlighted by the following color code: CoBaHMA (green), HMA_2 (lime), HMA (yellow), P-type (cyan) and Serca (darkblue), ABC (orange), Calcyanin Gly-Zip (red), PAP2 (magenta). Membrane regions as identified by deepTMHMM are indicated by gray areas. <strong>Supplementary Data 3 </strong>(.tsv file) Main features of communities (e.g. representative sequence, community size, mean amino acid length, annotations, …). <strong>Supplementary Data 4 </strong>(.tsv file) Mean features of sequences possessing CoBaHMA domain(s).
DOI: 10.11588/data/d7mize/4veswf
title: 4-4_dakuangshan_dehong.kmz
DOI: 10.11588/data/d7mize/narj7u
title: 2-5b_woqianchang_huize.kmz
DOI: 10.11588/data/d7mize/gp37bp
title: Ag-mines_regions.kmz
DOI: 10.11588/data/d7mize/papmrd
title: 4-1_mingguang_tengchong_2016-2018.pdf
DOI: 10.11588/data/d7mize/ujp8ba
title: 01_north_further_Ag-sites.kmz
DOI: 10.5281/zenodo.8387654
title: CoBaHMA domains: supplementary Table and Data

description: Supplementary Table and Supplementary Data 1 to 4 to the article "<strong>AlphaFold2-guided description of CoBaHMA, a novel family of bacterial domains within the Heavy-Metal Associated superfamily"</strong> <strong>Supplementary Table 1 </strong>(.xlsx file): <strong>Structural and functional annotations of the large communities of CobaHMA domain proteins.</strong> The number of community sequences matching a given profile (IPR or ECOD) is indicated. The color code corresponds to the following functional categories. For each IPR accession, the type of profile is indicated between brackets (D for domain, F for family, H for superfamily). <strong>Structural and functional annotations of small communities.</strong> Only the 20 small communities with at least one new annotation (e.g. not shared with the large communities, in grey and black) are detailed here. For these 20 communities, some annotations are shared with the large communities, corresponding only to P-type (cyan) and HMA (yellow). For a complete view of the annotations of the small communties, see <strong>Supplementary Figure 5</strong>. The number of community sequences matching a given profile (IPR or ECOD) is indicated. For each IPR accession, the type of profile is indicated between brackets (D for domain, F for family, H for superfamily). <strong>Supplementary Data 1 </strong>(.zip file): Multiple sequence alignments (MSA) of the sequences of the most populated communities, build using MAFFT and rendered using EspPript3. The first two lines report the 2D structures of the AF2 model of the representative sequence of the community, and its amino acid sequence. The initial MSA (fasta format) is also provided, together with the coordinates of the 3D structure model (pdb format) and the HCA plot (postcript file) of the representative sequence of the considered community. <strong>Supplementary Data 2 </strong>(.zip file): Annotations by communities: Modular organization of the full-length CoBaHMA domain proteins within the 48 large community (Functional annotations are indicated along the sequence by shaded areas. Each functional category of domain is highlighted by the following color code: CoBaHMA (green), HMA_2 (lime), HMA (yellow), P-type (cyan) and Serca (darkblue), ABC (orange), Calcyanin Gly-Zip (red), PAP2 (magenta). Membrane regions as identified by deepTMHMM are indicated by gray areas. <strong>Supplementary Data 3 </strong>(.tsv file) Main features of communities (e.g. representative sequence, community size, mean amino acid length, annotations, …). <strong>Supplementary Data 4 </strong>(.tsv file) Mean features of sequences possessing CoBaHMA domain(s).
DOI: 10.11588/data/d7mize/btkp0x
title: 3-7_longwangjian_eryuan_2020.pdf
DOI: 10.11588/data/d7mize/axr5km
title: 5-5_yongsheng_chuxiong_2019.pdf
DOI: 10.23641/asha.23582172
title: Resilience in children who stutter (Walsh et al., 2023)

description: <strong>Purpose:</strong> People who stutter often experience significant adverse impact related to stuttering. However, it is unclear how adverse impact develops in children who stutter (CWS) and whether there are protective factors that may mitigate its development. This study examined the relationship between resilience, a potentially protective factor, and stuttering’s adverse impact in CWS. Resilience comprises external factors, such as family support and access to resources as well as personal attributes, making it a comprehensive protective factor to explore. <strong>Method:</strong> One hundred forty-eight CWS aged 5–18 years completed the age-appropriate version of the Child and Youth Resilience Measure (CYRM) and the Overall Assessment of the Speaker’s Experience of Stuttering. Parents completed a caregiver version of the CYRM and a behavioral checklist for their child. The adverse impact of stuttering was modeled as a function of resilience (external, personal, and total), controlling for child age and behavioral checklist score. We also estimated correlations between child-report and parent-report CYRM measures to assess rater agreement. <strong>Results:</strong> Children reporting greater external, personal, or total resilience were more likely to experience lower degrees of adverse impact related to their stuttering. We documented stronger correlations between younger child and parent ratings of resilience and weaker correlations between older child and parent ratings. <strong>Conclusions:</strong> These results yield valuable insight into the variability of adverse impact experienced by CWS and offer empirical support for strength-based speech therapy approaches. We discuss the factors that contribute to a child’s resilience and provide practical suggestions for how clinicians can incorporate resilience-building strategies into intervention for children experiencing significant adverse impact from their stuttering. <strong>Supplemental Material S1.</strong> Internal consistency of OASES and CYRM-R sections (Cronbach’s alpha). Walsh, B. M., Grobbel, H., Christ, S. L., Tichenor, S. E., & Gerwin, K. L. (2023). Exploring the relationship between resilience and the adverse impact of stuttering in children. <em>Journal of Speech, Language, and Hearing Research</em>. Advance online publication. https://doi.org/10.1044/2023_JSLHR-23-00012
DOI: 10.23641/asha.23582172.v1
title: Resilience in children who stutter (Walsh et al., 2023)

description: <strong>Purpose:</strong> People who stutter often experience significant adverse impact related to stuttering. However, it is unclear how adverse impact develops in children who stutter (CWS) and whether there are protective factors that may mitigate its development. This study examined the relationship between resilience, a potentially protective factor, and stuttering’s adverse impact in CWS. Resilience comprises external factors, such as family support and access to resources as well as personal attributes, making it a comprehensive protective factor to explore. <strong>Method:</strong> One hundred forty-eight CWS aged 5–18 years completed the age-appropriate version of the Child and Youth Resilience Measure (CYRM) and the Overall Assessment of the Speaker’s Experience of Stuttering. Parents completed a caregiver version of the CYRM and a behavioral checklist for their child. The adverse impact of stuttering was modeled as a function of resilience (external, personal, and total), controlling for child age and behavioral checklist score. We also estimated correlations between child-report and parent-report CYRM measures to assess rater agreement. <strong>Results:</strong> Children reporting greater external, personal, or total resilience were more likely to experience lower degrees of adverse impact related to their stuttering. We documented stronger correlations between younger child and parent ratings of resilience and weaker correlations between older child and parent ratings. <strong>Conclusions:</strong> These results yield valuable insight into the variability of adverse impact experienced by CWS and offer empirical support for strength-based speech therapy approaches. We discuss the factors that contribute to a child’s resilience and provide practical suggestions for how clinicians can incorporate resilience-building strategies into intervention for children experiencing significant adverse impact from their stuttering. <strong>Supplemental Material S1.</strong> Internal consistency of OASES and CYRM-R sections (Cronbach’s alpha). Walsh, B. M., Grobbel, H., Christ, S. L., Tichenor, S. E., & Gerwin, K. L. (2023). Exploring the relationship between resilience and the adverse impact of stuttering in children. <em>Journal of Speech, Language, and Hearing Research</em>. Advance online publication. https://doi.org/10.1044/2023_JSLHR-23-00012
DOI: 10.5517/ccdc.csd.cc1z6nsm
title: CCDC 1823661: Experimental Crystal Structure Determination

description: Related Article: Stefan B. Lawrenson, Sam Hart, Ian D. V. Ingram, Michael North, Rachel R. Parker, Adrian C. Whitwood|2018|ACS Sustain.Chem.Eng.|6|9744|doi:10.1021/acssuschemeng.8b00779
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.