From b3b291e6dc2a159c6ec98deb5e2a32609d655520 Mon Sep 17 00:00:00 2001 From: Valeriu Predoi Date: Wed, 17 Sep 2025 15:17:31 +0100 Subject: [PATCH 01/28] add JOSS paper example to be edited in place --- paper.bib | 59 +++++++++++++++++++++++++++ paper.md | 120 ++++++++++++++++++++++++++++++++++++++++++++++++++++++ 2 files changed, 179 insertions(+) create mode 100644 paper.bib create mode 100644 paper.md diff --git a/paper.bib b/paper.bib new file mode 100644 index 0000000..4e4544a --- /dev/null +++ b/paper.bib @@ -0,0 +1,59 @@ +@article{Pearson:2017, + url = {http://adsabs.harvard.edu/abs/2017arXiv170304627P}, + Archiveprefix = {arXiv}, + Author = {{Pearson}, S. and {Price-Whelan}, A.~M. and {Johnston}, K.~V.}, + Eprint = {1703.04627}, + Journal = {ArXiv e-prints}, + Keywords = {Astrophysics - Astrophysics of Galaxies}, + Month = mar, + Title = {{Gaps in Globular Cluster Streams: Pal 5 and the Galactic Bar}}, + Year = 2017 +} + +@book{Binney:2008, + url = {http://adsabs.harvard.edu/abs/2008gady.book.....B}, + Author = {{Binney}, J. and {Tremaine}, S.}, + Booktitle = {Galactic Dynamics: Second Edition, by James Binney and Scott Tremaine.~ISBN 978-0-691-13026-2 (HB).~Published by Princeton University Press, Princeton, NJ USA, 2008.}, + Publisher = {Princeton University Press}, + Title = {{Galactic Dynamics: Second Edition}}, + Year = 2008 +} + +@article{gaia, + author = {{Gaia Collaboration}}, + title = "{The Gaia mission}", + journal = {Astronomy and Astrophysics}, + archivePrefix = "arXiv", + eprint = {1609.04153}, + primaryClass = "astro-ph.IM", + keywords = {space vehicles: instruments, Galaxy: structure, astrometry, parallaxes, proper motions, telescopes}, + year = 2016, + month = nov, + volume = 595, + doi = {10.1051/0004-6361/201629272}, + url = {http://adsabs.harvard.edu/abs/2016A%26A...595A...1G}, +} + +@article{astropy, + author = {{Astropy Collaboration}}, + title = "{Astropy: A community Python package for astronomy}", + journal = {Astronomy and Astrophysics}, + archivePrefix = "arXiv", + eprint = {1307.6212}, + primaryClass = "astro-ph.IM", + keywords = {methods: data analysis, methods: miscellaneous, virtual observatory tools}, + year = 2013, + month = oct, + volume = 558, + doi = {10.1051/0004-6361/201322068}, + url = {http://adsabs.harvard.edu/abs/2013A%26A...558A..33A} +} + +@misc{fidgit, + author = {A. M. Smith and K. Thaney and M. Hahnel}, + title = {Fidgit: An ungodly union of GitHub and Figshare}, + year = {2020}, + publisher = {GitHub}, + journal = {GitHub repository}, + url = {https://github.com/arfon/fidgit} +} diff --git a/paper.md b/paper.md new file mode 100644 index 0000000..91e17f4 --- /dev/null +++ b/paper.md @@ -0,0 +1,120 @@ +--- +title: 'Gala: A Python package for galactic dynamics' +tags: + - Python + - astronomy + - dynamics + - galactic dynamics + - milky way +authors: + - name: Adrian M. Price-Whelan + orcid: 0000-0000-0000-0000 + equal-contrib: true + affiliation: "1, 2" # (Multiple affiliations must be quoted) + - name: Author Without ORCID + equal-contrib: true # (This is how you can denote equal contributions between multiple authors) + affiliation: 2 + - name: Author with no affiliation + corresponding: true # (This is how to denote the corresponding author) + affiliation: 3 + - given-names: Ludwig + dropping-particle: van + surname: Beethoven + affiliation: 3 +affiliations: + - name: Lyman Spitzer, Jr. Fellow, Princeton University, United States + index: 1 + ror: 00hx57361 + - name: Institution Name, Country + index: 2 + - name: Independent Researcher, Country + index: 3 +date: 13 August 2017 +bibliography: paper.bib + +# Optional fields if submitting to a AAS journal too, see this blog post: +# https://blog.joss.theoj.org/2018/12/a-new-collaboration-with-aas-publishing +aas-doi: 10.3847/xxxxx <- update this with the DOI from AAS once you know it. +aas-journal: Astrophysical Journal <- The name of the AAS journal. +--- + +# Summary + +The forces on stars, galaxies, and dark matter under external gravitational +fields lead to the dynamical evolution of structures in the universe. The orbits +of these bodies are therefore key to understanding the formation, history, and +future state of galaxies. The field of "galactic dynamics," which aims to model +the gravitating components of galaxies to study their structure and evolution, +is now well-established, commonly taught, and frequently used in astronomy. +Aside from toy problems and demonstrations, the majority of problems require +efficient numerical tools, many of which require the same base code (e.g., for +performing numerical orbit integration). + +# Statement of need + +`Gala` is an Astropy-affiliated Python package for galactic dynamics. Python +enables wrapping low-level languages (e.g., C) for speed without losing +flexibility or ease-of-use in the user-interface. The API for `Gala` was +designed to provide a class-based and user-friendly interface to fast (C or +Cython-optimized) implementations of common operations such as gravitational +potential and force evaluation, orbit integration, dynamical transformations, +and chaos indicators for nonlinear dynamics. `Gala` also relies heavily on and +interfaces well with the implementations of physical units and astronomical +coordinate systems in the `Astropy` package [@astropy] (`astropy.units` and +`astropy.coordinates`). + +`Gala` was designed to be used by both astronomical researchers and by +students in courses on gravitational dynamics or astronomy. It has already been +used in a number of scientific publications [@Pearson:2017] and has also been +used in graduate courses on Galactic dynamics to, e.g., provide interactive +visualizations of textbook material [@Binney:2008]. The combination of speed, +design, and support for Astropy functionality in `Gala` will enable exciting +scientific explorations of forthcoming data releases from the *Gaia* mission +[@gaia] by students and experts alike. + +# Mathematics + +Single dollars ($) are required for inline mathematics e.g. $f(x) = e^{\pi/x}$ + +Double dollars make self-standing equations: + +$$\Theta(x) = \left\{\begin{array}{l} +0\textrm{ if } x < 0\cr +1\textrm{ else} +\end{array}\right.$$ + +You can also use plain \LaTeX for equations +\begin{equation}\label{eq:fourier} +\hat f(\omega) = \int_{-\infty}^{\infty} f(x) e^{i\omega x} dx +\end{equation} +and refer to \autoref{eq:fourier} from text. + +# Citations + +Citations to entries in paper.bib should be in +[rMarkdown](http://rmarkdown.rstudio.com/authoring_bibliographies_and_citations.html) +format. + +If you want to cite a software repository URL (e.g. something on GitHub without a preferred +citation) then you can do it with the example BibTeX entry below for @fidgit. + +For a quick reference, the following citation commands can be used: +- `@author:2001` -> "Author et al. (2001)" +- `[@author:2001]` -> "(Author et al., 2001)" +- `[@author1:2001; @author2:2001]` -> "(Author1 et al., 2001; Author2 et al., 2002)" + +# Figures + +Figures can be included like this: +![Caption for example figure.\label{fig:example}](figure.png) +and referenced from text using \autoref{fig:example}. + +Figure sizes can be customized by adding an optional second parameter: +![Caption for example figure.](figure.png){ width=20% } + +# Acknowledgements + +We acknowledge contributions from Brigitta Sipocz, Syrtis Major, and Semyeong +Oh, and support from Kathryn Johnston during the genesis of this project. + +# References From 23115fb41eab51f8be08ba1a832f0fbd851fe4ee Mon Sep 17 00:00:00 2001 From: Valeriu Predoi Date: Wed, 17 Sep 2025 16:13:23 +0100 Subject: [PATCH 02/28] started editing manuscript --- paper.md | 79 ++++++++++++++++++++------------------------------------ 1 file changed, 28 insertions(+), 51 deletions(-) diff --git a/paper.md b/paper.md index 91e17f4..9b9abe3 100644 --- a/paper.md +++ b/paper.md @@ -1,76 +1,53 @@ --- -title: 'Gala: A Python package for galactic dynamics' +title: 'Pyfive: the mother of all HDF5 battles.' tags: - Python - - astronomy - - dynamics - - galactic dynamics - - milky way + - Atmospheric Science + - Physics + - Climate Model Data + - Engineering authors: - - name: Adrian M. Price-Whelan + - name: Bryan Lawrence orcid: 0000-0000-0000-0000 equal-contrib: true affiliation: "1, 2" # (Multiple affiliations must be quoted) - - name: Author Without ORCID + - name: David Hassell equal-contrib: true # (This is how you can denote equal contributions between multiple authors) - affiliation: 2 - - name: Author with no affiliation - corresponding: true # (This is how to denote the corresponding author) - affiliation: 3 - - given-names: Ludwig - dropping-particle: van - surname: Beethoven - affiliation: 3 + affiliation: 1 + - name: Valeriu Predoi + equal-contrib: true # (This is how you can denote equal contributions between multiple authors) + affiliation: 1 affiliations: - - name: Lyman Spitzer, Jr. Fellow, Princeton University, United States + - name: NCAS-CMS, Meteorology Department, University of Reading, Reading, UK index: 1 ror: 00hx57361 - name: Institution Name, Country index: 2 - - name: Independent Researcher, Country - index: 3 -date: 13 August 2017 +date: 17 September 2025 bibliography: paper.bib -# Optional fields if submitting to a AAS journal too, see this blog post: -# https://blog.joss.theoj.org/2018/12/a-new-collaboration-with-aas-publishing -aas-doi: 10.3847/xxxxx <- update this with the DOI from AAS once you know it. -aas-journal: Astrophysical Journal <- The name of the AAS journal. --- # Summary -The forces on stars, galaxies, and dark matter under external gravitational -fields lead to the dynamical evolution of structures in the universe. The orbits -of these bodies are therefore key to understanding the formation, history, and -future state of galaxies. The field of "galactic dynamics," which aims to model -the gravitating components of galaxies to study their structure and evolution, -is now well-established, commonly taught, and frequently used in astronomy. -Aside from toy problems and demonstrations, the majority of problems require -efficient numerical tools, many of which require the same base code (e.g., for -performing numerical orbit integration). +Pyfive () is an open-source thread-safe pure Python package for reading data stored in HDF5. While it is not a complete implementation of all the capabilities of HDF5, it includes all the core functionality necessary to read gridded datasets, whether stored contiguously or with chunks, and to carry out the necessary decompression for the standard options (INCLUDE OPTIONS). All data access is fully lazy, the data is only read from storage when the numpy data arrays are manipulated. Originally developed as a prototype some years ago, the package has recently been upgraded to make it more maintainable and fully featured for handling all the environmental data known to the authors, and hence a realistic option for production data access in environmental science and more widely. The API is based on that of h5py (which is a python shimmy over the HDF5 c-library, and hence is not thread-safe), with some API extensions to help optimise remote access. # Statement of need -`Gala` is an Astropy-affiliated Python package for galactic dynamics. Python -enables wrapping low-level languages (e.g., C) for speed without losing -flexibility or ease-of-use in the user-interface. The API for `Gala` was -designed to provide a class-based and user-friendly interface to fast (C or -Cython-optimized) implementations of common operations such as gravitational -potential and force evaluation, orbit integration, dynamical transformations, -and chaos indicators for nonlinear dynamics. `Gala` also relies heavily on and -interfaces well with the implementations of physical units and astronomical -coordinate systems in the `Astropy` package [@astropy] (`astropy.units` and -`astropy.coordinates`). - -`Gala` was designed to be used by both astronomical researchers and by -students in courses on gravitational dynamics or astronomy. It has already been -used in a number of scientific publications [@Pearson:2017] and has also been -used in graduate courses on Galactic dynamics to, e.g., provide interactive -visualizations of textbook material [@Binney:2008]. The combination of speed, -design, and support for Astropy functionality in `Gala` will enable exciting -scientific explorations of forthcoming data releases from the *Gaia* mission -[@gaia] by students and experts alike. +HDF5 is probably the most important data format in environmental science, particularly given the fact that NetCDF4 is HDF5 under the hood. From satellite missions, to climate models and radar systems, the default binary format has been HDF5 for decades. While newer formats are starting to get mindshare, there are petabytes, if not exabytes of existing HDF5, and there are still many good use-cases for creating new data in HDF5. However, despite the history, there are few libraries for reading HDF5 file data that do not depend on the official HDF5 library maintained by the HDFGroup, and in particular, there are none that can be used with Python. +While the HDF5 c-library is reliable and performant, and battle-tested over decades, there are some caveats to depending upon it: Firstly, it is not thread-safe, and secondly, the code is large and complex, and should anything happen to the financial stability of The HDF5group, it is not obvious the C-code could be maintained. From a long-term curation perspective this last constraint is a concern. + +pyfive was developed with the use-case of performant remote access to curated data as the primary motivation, but with additional motivations of having a lightweight HDF5 reader capable of deploying in resource or operating-system constrained environments (such as mobile), and one that could be maintained long-term as a reference reader for curation purposes. The lightweight deployment consequences of a pure-python HDF5 reader need no further introduction, but as additional motivation we now expand on the issues around remote access and curation. + +Taking remote access first, one of the reasons for the rapid adoption of pure-python tools like xarray with zarr has been the ability for thread-safe parallelism using dask. Any python solution based on the HDF5 c-library could not meet this requirement, which led to the development of kerchunk mediated direct access to chunked HDF5 data (https://fsspec.github.io/kerchunk/). However, in practice using kerchunk requires the data provider to generate kerchunk indices to support remote users, and it leads to issues of synchronicity between indices and changing datasets. pyfive was developed in such a way to have all the benefits of using kerchunk, but without the need for provider support. Because pyfive can access and cache (in the client) the b-tree (index) on a variable-by-variable basis, most of the benefits of kerchunk are gained without any of the constraints. The one advantage left to kerchunk is that the kerchunk index is always a contiguous object accessible with one get transaction, this is not necessarily the case with the b-tree, unless the source data has been repacked to ensure contiguous metadata using a tool like h5repack. However, in practice, for many use cases, b-tree extraction with pyfive will be comparable in performance to obtaining a kerchunk index, and completely opaque to the user. + +The issues of the dependency on a complex code maintained by one private company in the context of maintaining data access (over decades, and potentially centuries), can only be mitigated by ensuring that the data format is well documented, that data writers use only the documented features, and that public code exists which can be relatively easily maintained. The HDF5group have provided good documentation for the core features of HDF5 which include all those of interest to the weather and climate community who motivated this reboot of pyfive, and while there is a community of developers beyond the HDF5 group (including some at the publicly funded Unidata institution), recent events suggest that given most of those developers and their existing funding are US based, some spreading of risk would be desirable. To that end, a pure-python code, which is relatively small and maintained by an international constituency, alongside the existing c-code, provides some assurance that the community can maintain HDF5 access for the foreseeable future. + +# Examples + +A notable feature of the recent pyfive upgrade is that it was carried out with thread-safety and remote access using fsspec (filesystem-spec.readthedocs.io) in mind. We provide two examples of using pyfive to access remote data, one in S3, and one behind a modern http web server: + +v.predoi@ncas.ac.uk When we have this is markdown, can you please put two python examples in here as above! # Mathematics From dc000f90954e1acd2c20790b354eeb9a28bc3858 Mon Sep 17 00:00:00 2001 From: Valeriu Predoi Date: Fri, 19 Sep 2025 12:20:22 +0100 Subject: [PATCH 03/28] commit draft pdf paper to here --- .github/workflows/joss-draft-pdf.yml | 8 +++++++- 1 file changed, 7 insertions(+), 1 deletion(-) diff --git a/.github/workflows/joss-draft-pdf.yml b/.github/workflows/joss-draft-pdf.yml index 87f7486..52dd849 100644 --- a/.github/workflows/joss-draft-pdf.yml +++ b/.github/workflows/joss-draft-pdf.yml @@ -24,7 +24,13 @@ jobs: journal: joss # This should be the path to the paper within your repo. paper-path: paper.md - - name: Upload + - name: Commit draft PDF to repository + uses: EndBug/add-and-commit@v9 + with: + message: '(auto) Paper PDF Draft' + # This should be 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b/paper.md index 9b9abe3..6e5b104 100644 --- a/paper.md +++ b/paper.md @@ -17,11 +17,14 @@ authors: - name: Valeriu Predoi equal-contrib: true # (This is how you can denote equal contributions between multiple authors) affiliation: 1 + - name: Ezequiel Cimadevilla + equal-contrib: true # (This is how you can denote equal contributions between multiple authors) + affiliation: 2 affiliations: - name: NCAS-CMS, Meteorology Department, University of Reading, Reading, UK index: 1 ror: 00hx57361 - - name: Institution Name, Country + - name: Institution Name, Spain index: 2 date: 17 September 2025 bibliography: paper.bib From da8075b2676ec3cb9dca81ad6858deb3505f47c5 Mon Sep 17 00:00:00 2001 From: valeriupredoi Date: Fri, 19 Sep 2025 11:36:55 +0000 Subject: [PATCH 07/28] (auto) Paper PDF Draft --- paper.pdf | Bin 214675 -> 215068 bytes 1 file changed, 0 insertions(+), 0 deletions(-) diff --git a/paper.pdf b/paper.pdf index 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z5_`w(b8mb<7yAh`G$rT5V(#~J=NBEZ^d8w+^0CtV&pw2 z11qO5uyIdMsi7pv Date: Fri, 19 Sep 2025 14:11:22 +0100 Subject: [PATCH 08/28] example trigger --- paper.md | 4 ++++ 1 file changed, 4 insertions(+) diff --git a/paper.md b/paper.md index 6e5b104..86c0822 100644 --- a/paper.md +++ b/paper.md @@ -46,6 +46,10 @@ Taking remote access first, one of the reasons for the rapid adoption of pure-py The issues of the dependency on a complex code maintained by one private company in the context of maintaining data access (over decades, and potentially centuries), can only be mitigated by ensuring that the data format is well documented, that data writers use only the documented features, and that public code exists which can be relatively easily maintained. The HDF5group have provided good documentation for the core features of HDF5 which include all those of interest to the weather and climate community who motivated this reboot of pyfive, and while there is a community of developers beyond the HDF5 group (including some at the publicly funded Unidata institution), recent events suggest that given most of those developers and their existing funding are US based, some spreading of risk would be desirable. To that end, a pure-python code, which is relatively small and maintained by an international constituency, alongside the existing c-code, provides some assurance that the community can maintain HDF5 access for the foreseeable future. +# F16 Wild Weasel + +Tis cool. + # Examples A notable feature of the recent pyfive upgrade is that it was carried out with thread-safety and remote access using fsspec (filesystem-spec.readthedocs.io) in mind. 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zC!64vQC7fwyprgSsgGr&58qq`P*|(K0wD*9lbG&iyuf^w!Hz4h5Gl0k+vg*mn^_e( zj>(HGDh3ih5;g#8eCh-UOUjH(MQ{Ghzh=J_+#cn2E(?0C-I}ihc-(KG5cR=@;$zmq zsJDv$x1=sr`s02TM<|rhp2}O9Vy}8129Tsu>91mJejWWj0dqwD5Bk zt{uu3sIh5$ZZyO(Z0{oB4Kt4502Kl@l?Ih)mE^MlYS))Wma{9U^oqxKT|`h$rXgCS zZz6q!qI`I_sPiI(+u|jI@})dgMSihG(2G9up?*g@*;@PQD%A6L=Q}4xpbFrdQQ;W%oqy9e*?xf%V From bfead76babfc1dd9947487da8ded80f4665bc182 Mon Sep 17 00:00:00 2001 From: Valeriu Predoi Date: Fri, 19 Sep 2025 14:35:02 +0100 Subject: [PATCH 10/28] remove bit I added for demo --- paper.md | 4 ---- 1 file changed, 4 deletions(-) diff --git a/paper.md b/paper.md index 86c0822..6e5b104 100644 --- a/paper.md +++ b/paper.md @@ -46,10 +46,6 @@ Taking remote access first, one of the reasons for the rapid adoption of pure-py The issues of the dependency on a complex code maintained by one private company in the context of maintaining data access (over decades, and potentially centuries), can only be mitigated by ensuring that the data format is well documented, that data writers use only the documented features, and that public code exists which can be relatively easily maintained. The HDF5group have provided good documentation for the core features of HDF5 which include all those of interest to the weather and climate community who motivated this reboot of pyfive, and while there is a community of developers beyond the HDF5 group (including some at the publicly funded Unidata institution), recent events suggest that given most of those developers and their existing funding are US based, some spreading of risk would be desirable. To that end, a pure-python code, which is relatively small and maintained by an international constituency, alongside the existing c-code, provides some assurance that the community can maintain HDF5 access for the foreseeable future. -# F16 Wild Weasel - -Tis cool. - # Examples A notable feature of the recent pyfive upgrade is that it was carried out with thread-safety and remote access using fsspec (filesystem-spec.readthedocs.io) in mind. We provide two examples of using pyfive to access remote data, one in S3, and one behind a modern http web server: From d20190e48063a8763fb021fab352b04bfad8617e Mon Sep 17 00:00:00 2001 From: valeriupredoi Date: Fri, 19 Sep 2025 13:35:48 +0000 Subject: [PATCH 11/28] (auto) Paper PDF Draft --- paper.pdf | Bin 216233 -> 215068 bytes 1 file changed, 0 insertions(+), 0 deletions(-) diff --git a/paper.pdf b/paper.pdf index de887dc723ce368e09e9be50ff48434d0c38793a..34a3f99defee7a944337e2ba527a1ae1b133e6a6 100644 GIT binary patch delta 14763 zcmajG1z42d);=sVpoB% zJ@0$Y^?ldHzILp=_gd>-d*<15FP_3g%#=vXiVJkaPbiSF`Y8sK8~}kK_Lz{~#1?r1T0+VJjyNm;39~vbX2;ZSv9NkgNI6*5mZ=jS%Tz z+pp>T9N(q#;CrX-Q7EI!?YE9_W&Kx!$T%wR^ACT{(e7MFOqCxhnKRJ}|9G7rA;0{s z&t@6EG&gsC-P(Fvb=)oJuoR1wsSDF2^PkGJqwh79B@u0l*B)#->5^F0ZNHgHhZjt3 zE}MOOeNaZ=4>>s7YQ;}FWenb_0SCy5J`cNgpvoDdtT`H_D$a^k^WKSsw=EoHdi_{# zIQvrn6OU|ja~*RKwK`{v<{Y&hM4reC^x#Pbouo0!vy&%x|;1b zURj|x`xc01w^(ZzBKwgQ={mvJvkw#B*2Oj1OWI7NSx?`xS~+H-e5wt2;Z>(_NHo7V 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While it is not a complete implementation of all the capabilities of HDF5, it includes all the core functionality necessary to read gridded datasets, whether stored contiguously or with chunks, and to carry out the necessary decompression for the standard options (INCLUDE OPTIONS). All data access is fully lazy, the data is only read from storage when the numpy data arrays are manipulated. Originally developed as a prototype some years ago, the package has recently been upgraded to make it more maintainable and fully featured for handling all the environmental data known to the authors, and hence a realistic option for production data access in environmental science and more widely. The API is based on that of h5py (which is a python shimmy over the HDF5 c-library, and hence is not thread-safe), with some API extensions to help optimise remote access. +Pyfive () is an open-source thread-safe pure Python package for reading data stored in HDF5. While it is not a complete implementation of all the capabilities of HDF5, it includes all the core functionality necessary to read gridded datasets, whether stored contiguously or with chunks, and to carry out the necessary decompression for the standard options (INCLUDE OPTIONS). All data access is fully lazy, the data is only read from storage when the numpy data arrays are manipulated. Originally developed some years ago, the package has recently been upgraded to support +lazy access, and to add missing features necessary for handling all the environmental data known to the authors. It is now a realistic option for production data access in environmental science and more widely. The API is based on that of h5py (which is a python shimmy over the HDF5 c-library, and hence is not thread-safe), with some API extensions to help optimise remote access. # Statement of need HDF5 is probably the most important data format in environmental science, particularly given the fact that NetCDF4 is HDF5 under the hood. From satellite missions, to climate models and radar systems, the default binary format has been HDF5 for decades. While newer formats are starting to get mindshare, there are petabytes, if not exabytes of existing HDF5, and there are still many good use-cases for creating new data in HDF5. However, despite the history, there are few libraries for reading HDF5 file data that do not depend on the official HDF5 library maintained by the HDFGroup, and in particular, there are none that can be used with Python. While the HDF5 c-library is reliable and performant, and battle-tested over decades, there are some caveats to depending upon it: Firstly, it is not thread-safe, and secondly, the code is large and complex, and should anything happen to the financial stability of The HDF5group, it is not obvious the C-code could be maintained. From a long-term curation perspective this last constraint is a concern. -pyfive was developed with the use-case of performant remote access to curated data as the primary motivation, but with additional motivations of having a lightweight HDF5 reader capable of deploying in resource or operating-system constrained environments (such as mobile), and one that could be maintained long-term as a reference reader for curation purposes. The lightweight deployment consequences of a pure-python HDF5 reader need no further introduction, but as additional motivation we now expand on the issues around remote access and curation. +The original implementation of pyfive (by JH and BM), which included all the low-level functionality to deal with the internals of an HDF5 file was developed with POSIX access in mind. The recent upgrades were developed with the use-case of performant remote access to curated data as the primary motivation, but with additional motivations of having a lightweight HDF5 reader capable of deploying in resource or operating-system constrained environments (such as mobile), and one that could be maintained long-term as a reference reader for curation purposes. The lightweight deployment consequences of a pure-python HDF5 reader need no further introduction, but as additional motivation we now expand on the issues around remote access and curation. Taking remote access first, one of the reasons for the rapid adoption of pure-python tools like xarray with zarr has been the ability for thread-safe parallelism using dask. Any python solution based on the HDF5 c-library could not meet this requirement, which led to the development of kerchunk mediated direct access to chunked HDF5 data (https://fsspec.github.io/kerchunk/). However, in practice using kerchunk requires the data provider to generate kerchunk indices to support remote users, and it leads to issues of synchronicity between indices and changing datasets. pyfive was developed in such a way to have all the benefits of using kerchunk, but without the need for provider support. Because pyfive can access and cache (in the client) the b-tree (index) on a variable-by-variable basis, most of the benefits of kerchunk are gained without any of the constraints. The one advantage left to kerchunk is that the kerchunk index is always a contiguous object accessible with one get transaction, this is not necessarily the case with the b-tree, unless the source data has been repacked to ensure contiguous metadata using a tool like h5repack. However, in practice, for many use cases, b-tree extraction with pyfive will be comparable in performance to obtaining a kerchunk index, and completely opaque to the user. 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handling all the environm # Statement of need -HDF5 is probably the most important data format in environmental science, particularly given the fact that NetCDF4 is HDF5 under the hood. From satellite missions, to climate models and radar systems, the default binary format has been HDF5 for decades. While newer formats are starting to get mindshare, there are petabytes, if not exabytes of existing HDF5, and there are still many good use-cases for creating new data in HDF5. However, despite the history, there are few libraries for reading HDF5 file data that do not depend on the official HDF5 library maintained by the HDFGroup, and in particular, there are none that can be used with Python. +HDF5 is probably the most important data format in physical science, used across the piste.It is particularly important in environmental science, particularly given the fact that NetCDF4 is HDF5 under the hood. From satellite missions, to climate models and radar systems, the default binary format has been HDF5 for decades. While newer formats are starting to get mindshare, there are petabytes, if not exabytes of existing HDF5, and there are still many good use-cases for creating new data in HDF5. However, despite the history, there are few libraries for reading HDF5 file data that do not depend on the official HDF5 library maintained by the HDFGroup, and in particular, there are none that can be used with Python. While the HDF5 c-library is reliable and performant, and battle-tested over decades, there are some caveats to depending upon it: Firstly, it is not thread-safe, and secondly, the code is large and complex, and should anything happen to the financial stability of The HDF5group, it is not obvious the C-code could be maintained. From a long-term curation perspective this last constraint is a concern. The original implementation of pyfive (by JH and BM), which included all the low-level functionality to deal with the internals of an HDF5 file was developed with POSIX access in mind. The recent upgrades were developed with the use-case of performant remote access to curated data as the primary motivation, but with additional motivations of having a lightweight HDF5 reader capable of deploying in resource or operating-system constrained environments (such as mobile), and one that could be maintained long-term as a reference reader for curation purposes. The lightweight deployment consequences of a pure-python HDF5 reader need no further introduction, but as additional motivation we now expand on the issues around remote access and curation. 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z7*&!}P0Y+qP0V!7)65ffO;QsrbS;xD4RjMNEKf4KH$TNCu_RSN!^O(Tz{u3V(g-TK-OHKzIGdY=k&C05nVGYxk*k@Zle3Ab qnSrsPtAT~Hi-nPap@F5Hf(>CMvC|*6GRaN1+s!1gz1NHRCL;iP>O~6x delta 254 zcmaDhgZJ4C-i9rV+m>+|h8UPz8JSxdSZ+VCjFE{MNnrY!m5fHne2!I&CP@74ZmSq2 z7*&i@O$<|#Ee&)NQ`5|KP14LwbuA4{({xjkP0Y;G%+rj_%oE$2Rx@sITFta%x{9HJ zxskbnWt66ZzHfetOJYf?f`*Hgk%5t^fu#{ta=Vu^^Kmve10xGFM?+UPM Date: Mon, 22 Sep 2025 13:46:00 +0100 Subject: [PATCH 17/28] Predoi correct ORCID number --- paper.md | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/paper.md b/paper.md index b0a5462..46d0734 100644 --- a/paper.md +++ b/paper.md @@ -23,7 +23,7 @@ authors: - name: Kai Mühlbauer affiliation: 5 - name: Valeriu Predoi - orcid: 0000-0002-9729-657 + orcid: 0000-0002-9729-6578 affiliation: 1 affiliations: - name: NCAS-CMS, Meteorology Department, University of Reading, Reading, UK From 5bf3868d280c1cfb2904d6cca35d92fd91a04181 Mon Sep 17 00:00:00 2001 From: valeriupredoi Date: Mon, 22 Sep 2025 12:46:49 +0000 Subject: [PATCH 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zQDJ}0gHJ72&roI?EA890^N3SA?JpRG+sCRCmkp|45O6sA8<;wmlIPXs)otSv`~Dbk z5A?yD0q&MXhS>1g$Y?-)GRKD4=06riRV^l@C}N2)yWmP$ z_RXW4Zo8Pep{HHPv%UQ|EdKj8hJf2_K%1Q`>fLuOj{R?}Dn6?#UJHPuQ93p%%M*c{ z&k<&Zd-XhGjh2eSZ$F2AJEt!z30Ws^buflE5tMUstiVy&cOraGP<=27pNq`FYPl&I zl&7odzplGj_Z%I)2-S`=LN}_rJ~>QXjHWSu<1#~Td@?`3OML(xyUaZ`JO37w9+%(k z)lEARdTo?^)09q+eXf*z6PVmhywVNB?|W(HOKLucMCze&S@J>qsbX*y1DsLYUH*RXIhBcj>9_k{`-?#UQj+Rajy~moxsrcu~K}3LCMiK&nNb_;aLcmheynGNY z9y;}>d7__#a{8@8dK zv!8XD9~y?ddB*n{({ag^y-i`F!t>zSVihcTQ>8dwtBU74B6hg+Zdo~F zr$SMe2^TQ;4mjd@HZu7=PtDw97pbgsXVMRA-!TaOvv*iiRW Date: Mon, 22 Sep 2025 17:59:03 +0100 Subject: [PATCH 19/28] Added Wout De Nolf's details and use case, and addressed Brian's request to modify the history --- paper.md | 34 +++++++++++++++++++++++++--------- 1 file changed, 25 insertions(+), 9 deletions(-) diff --git a/paper.md b/paper.md index b0a5462..342a2e4 100644 --- a/paper.md +++ b/paper.md @@ -12,6 +12,9 @@ authors: affiliation: 1 # (Multiple affiliations must be quoted) - name: Ezequiel Cimadevilla affiliation: 2 + - name: Wout De Nolf + affiliation: 6 + orcid: 0000-0003-2258-9402 - name: David Hassell orcid: 0000-0002-5312-4950 affiliation: 1 @@ -26,7 +29,7 @@ authors: orcid: 0000-0002-9729-657 affiliation: 1 affiliations: - - name: NCAS-CMS, Meteorology Department, University of Reading, Reading, UK + - name: NCAS-CMS, Meteorology Department, University of Reading, Reading, United Kingdom. index: 1 ror: 00hx57361 - name: Institution Name, Spain @@ -35,8 +38,9 @@ affiliations: index: 3 - name: NIST Center for Neutron Research index: 4 - - name: Institute for Geophysics, University of Bonn + - name: Institute for Geophysics, University of Bonn, Germany. index: 5 + - name: European Synchrotron Radiation Facility (ESRF), Grenoble, France. date: 21 September 2025 bibliography: paper.bib @@ -44,19 +48,31 @@ bibliography: paper.bib # Summary -Pyfive () is an open-source thread-safe pure Python package for reading data stored in HDF5. While it is not a complete implementation of all the capabilities of HDF5, it includes all the core functionality necessary to read gridded datasets, whether stored contiguously or with chunks, and to carry out the necessary decompression for the standard options (INCLUDE OPTIONS). All data access is fully lazy, the data is only read from storage when the numpy data arrays are manipulated. Originally developed some years ago, the package has recently been upgraded to support -lazy access, and to add missing features necessary for handling all the environmental data known to the authors. It is now a realistic option for production data access in environmental science and more widely. The API is based on that of h5py (which is a python shimmy over the HDF5 c-library, and hence is not thread-safe), with some API extensions to help optimise remote access. +Pyfive () is an open-source thread-safe pure Python package for reading data stored in HDF5. While it is not a complete implementation of all the capabilities of HDF5, it includes all the core functionality necessary to read gridded datasets, whether stored contiguously or with chunks, and to carry out the necessary decompression for the standard options (INCLUDE OPTIONS). +All data access is fully lazy, the data is only read from storage when the numpy data arrays are manipulated. Originally developed some years ago, the package has recently been upgraded to support +lazy access, and to add missing features necessary for handling all the environmental data known to the authors. It is now a realistic option for production data access in environmental science and more widely. +The API is based on that of h5py (which is a python shimmy over the HDF5 c-library, and hence is not thread-safe), with some API extensions to help optimise remote access. # Statement of need -HDF5 is probably the most important data format in physical science, used across the piste.It is particularly important in environmental science, particularly given the fact that NetCDF4 is HDF5 under the hood. From satellite missions, to climate models and radar systems, the default binary format has been HDF5 for decades. While newer formats are starting to get mindshare, there are petabytes, if not exabytes of existing HDF5, and there are still many good use-cases for creating new data in HDF5. However, despite the history, there are few libraries for reading HDF5 file data that do not depend on the official HDF5 library maintained by the HDFGroup, and in particular, there are none that can be used with Python. -While the HDF5 c-library is reliable and performant, and battle-tested over decades, there are some caveats to depending upon it: Firstly, it is not thread-safe, and secondly, the code is large and complex, and should anything happen to the financial stability of The HDF5group, it is not obvious the C-code could be maintained. From a long-term curation perspective this last constraint is a concern. +HDF5 is probably the most important data format in physical science, used across the piste.It is particularly important in environmental science, particularly given the fact that NetCDF4 is HDF5 under the hood. +From satellite missions, to climate models and radar systems, the default binary format has been HDF5 for decades. While newer formats are starting to get mindshare, there are petabytes, if not exabytes of existing HDF5, and there are still many good use-cases for creating new data in HDF5. +However, despite the history, there are few libraries for reading HDF5 file data that do not depend on the official HDF5 library maintained by the HDFGroup, and in particular, apart from pyfive, in Python there are none that cover the needs of environmental science. +While the HDF5 c-library is reliable and performant, and battle-tested over decades, there are some caveats to depending upon it: Firstly, it is not thread-safe, secondly, the code is large and complex, and should anything happen to the financial stability of The HDF5group, it is not obvious the C-code could be maintained, finally, the code complexity also meant that it was not suitable for developing bespoke code for data recovery in the case of partially corrupt data. From a long-term curation perspective both of these last two constraints are a concern. -The original implementation of pyfive (by JH and BM), which included all the low-level functionality to deal with the internals of an HDF5 file was developed with POSIX access in mind. The recent upgrades were developed with the use-case of performant remote access to curated data as the primary motivation, but with additional motivations of having a lightweight HDF5 reader capable of deploying in resource or operating-system constrained environments (such as mobile), and one that could be maintained long-term as a reference reader for curation purposes. The lightweight deployment consequences of a pure-python HDF5 reader need no further introduction, but as additional motivation we now expand on the issues around remote access and curation. +The original implementation of pyfive (by JH), which included all the low-level functionality to deal with the internals of an HDF5 file was developed with POSIX access in mind. +The recent upgrades were developed with the use-case of performant remote access to curated data as the primary motivation, but with additional motivations of having a lightweight HDF5 reader capable of deploying in resource or operating-system constrained environments (such as mobile), and one that could be maintained long-term as a reference reader for curation purposes. +The lightweight deployment consequences of a pure-python HDF5 reader need no further introduction, but as additional motivation we now expand on the issues around remote access and curation. -Taking remote access first, one of the reasons for the rapid adoption of pure-python tools like xarray with zarr has been the ability for thread-safe parallelism using dask. Any python solution based on the HDF5 c-library could not meet this requirement, which led to the development of kerchunk mediated direct access to chunked HDF5 data (https://fsspec.github.io/kerchunk/). However, in practice using kerchunk requires the data provider to generate kerchunk indices to support remote users, and it leads to issues of synchronicity between indices and changing datasets. pyfive was developed in such a way to have all the benefits of using kerchunk, but without the need for provider support. Because pyfive can access and cache (in the client) the b-tree (index) on a variable-by-variable basis, most of the benefits of kerchunk are gained without any of the constraints. The one advantage left to kerchunk is that the kerchunk index is always a contiguous object accessible with one get transaction, this is not necessarily the case with the b-tree, unless the source data has been repacked to ensure contiguous metadata using a tool like h5repack. However, in practice, for many use cases, b-tree extraction with pyfive will be comparable in performance to obtaining a kerchunk index, and completely opaque to the user. +Taking remote access first, one of the reasons for the rapid adoption of pure-python tools like xarray with zarr has been the ability for thread-safe parallelism using dask. Any python solution based on the HDF5 c-library could not meet this requirement, which led to the development of kerchunk mediated direct access to chunked HDF5 data (https://fsspec.github.io/kerchunk/). +However, in practice using kerchunk requires the data provider to generate kerchunk indices to support remote users, and it leads to issues of synchronicity between indices and changing datasets. pyfive was developed in such a way to have all the benefits of using kerchunk, but without the need for provider support. Because pyfive can access and cache (in the client) the b-tree (index) on a variable-by-variable basis, most of the benefits of kerchunk are gained without any of the constraints. +The one advantage left to kerchunk is that the kerchunk index is always a contiguous object accessible with one get transaction, this is not necessarily the case with the b-tree, unless the source data has been repacked to ensure contiguous metadata using a tool like h5repack. +However, in practice, for many use cases, b-tree extraction with pyfive will be comparable in performance to obtaining a kerchunk index, and completely opaque to the user. -The issues of the dependency on a complex code maintained by one private company in the context of maintaining data access (over decades, and potentially centuries), can only be mitigated by ensuring that the data format is well documented, that data writers use only the documented features, and that public code exists which can be relatively easily maintained. The HDF5group have provided good documentation for the core features of HDF5 which include all those of interest to the weather and climate community who motivated this reboot of pyfive, and while there is a community of developers beyond the HDF5 group (including some at the publicly funded Unidata institution), recent events suggest that given most of those developers and their existing funding are US based, some spreading of risk would be desirable. To that end, a pure-python code, which is relatively small and maintained by an international constituency, alongside the existing c-code, provides some assurance that the community can maintain HDF5 access for the foreseeable future. +The issues of the dependency on a complex code maintained by one private company in the context of maintaining data access (over decades, and potentially centuries), can only be mitigated by ensuring that the data format is well documented, that data writers use only the documented features, and that public code exists which can be relatively easily maintained. +The HDF5group have provided good documentation for the core features of HDF5 which include all those of interest to the weather and climate community who motivated this reboot of pyfive, and while there is a community of developers beyond the HDF5 group (including some at the publicly funded Unidata institution), recent events suggest that given most of those developers and their existing funding are US based, some spreading of risk would be desirable. +To that end, a pure-python code, which is relatively small and maintained by an international constituency, alongside the existing c-code, provides some assurance that the community can maintain HDF5 access for the foreseeable future. +A pure python code also makes it easier to develop scripts which can work around data and metadata damage should they occur. # Examples From f07f89b123d9b900a675d5e79d16cee1259e45f2 Mon Sep 17 00:00:00 2001 From: bnlawrence Date: Mon, 22 Sep 2025 17:03:08 +0000 Subject: [PATCH 20/28] (auto) Paper PDF Draft --- paper.pdf | Bin 216224 -> 217463 bytes 1 file changed, 0 insertions(+), 0 deletions(-) diff --git a/paper.pdf b/paper.pdf index 4a90248fcf7e07a8305e918c773a7bcfb052037a..2bb4b43e3d18bc5a9915b5a12f50859d2e369c92 100644 GIT binary patch delta 23788 zcmZtt1yEc~*Y^v<;O;KL-3E7ecMICFukyw8X_z+#2{wQN#3RiP94_w{$mP{0b&CFD%=OXn9?)QjGRTK`ni6<*n 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zyMZoMVPGJfe^nb}A4o!j)fGt6UHER3x0o9nr0L?36w%I^m)k+}nPdp+@mRy>yyX>U ZIf?B#Qd Date: Tue, 23 Sep 2025 14:37:37 +0000 Subject: [PATCH 21/28] (auto) Paper PDF Draft --- paper.pdf | Bin 217463 -> 217463 bytes 1 file changed, 0 insertions(+), 0 deletions(-) diff --git a/paper.pdf b/paper.pdf index 2bb4b43e3d18bc5a9915b5a12f50859d2e369c92..64036d9987b25ca7d992c5c8a02ab27d44b13e8a 100644 GIT binary patch delta 244 zcmeyqi1+&<-i9rVla_NEhZvez8Jk-fnMF;PU(6^m{cZ~*_x1zJ8QGY*5OUKmtYS1m z=JTv(G(qBT_gc*;!KjjEZfcTjX<(q6n3|TNYhs>eq?=@BZmMf(YGP)TWR{$2VwT+A zwuW(g+Zrb2Iqb%UCdTGQX45x#FpI%B+s}G1hq1XC8@L)7yO^69nYkHSIvctf8#4Ia#5FwXX~9?W5EZWcyHj%J3IhK3dv24;q?&W>*8CQg5=BB2mE_Mnwgq6fjFPz0Bx4qq;`2!;W8JI)N From 59f33f32caa2f560bac6b1b7f5e37b0957662be5 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Kai=20M=C3=BChlbauer?= Date: Mon, 29 Sep 2025 09:10:22 +0200 Subject: [PATCH 22/28] fix affiliation and add orcid for Kai --- paper.md | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/paper.md b/paper.md index 15926f1..2c52361 100644 --- a/paper.md +++ b/paper.md @@ -24,6 +24,7 @@ authors: orcid: 0000-0002-6105-8789 affiliation: 4 - name: Kai Mühlbauer + orcid: 0000-0001-6599-1034 affiliation: 5 - name: Valeriu Predoi orcid: 0000-0002-9729-6578 @@ -38,7 +39,7 @@ affiliations: index: 3 - name: NIST Center for Neutron Research index: 4 - - name: Institute for Geophysics, University of Bonn, Germany. + - name: Institute of Geosciences, Meteorology Section, University of Bonn, Germany. index: 5 - name: European Synchrotron Radiation Facility (ESRF), Grenoble, France. date: 21 September 2025 From 69a408179781eb9096ca65e9015cc4f3c45277c1 Mon Sep 17 00:00:00 2001 From: kmuehlbauer Date: Mon, 29 Sep 2025 07:13:37 +0000 Subject: [PATCH 23/28] (auto) Paper PDF Draft --- paper.pdf | Bin 217463 -> 217574 bytes 1 file changed, 0 insertions(+), 0 deletions(-) diff --git a/paper.pdf b/paper.pdf index 64036d9987b25ca7d992c5c8a02ab27d44b13e8a..29284fc926982dc561d47328db221be88f3fd003 100644 GIT binary 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2025 16:01:47 +0200 Subject: [PATCH 24/28] added couple of paragraphs about remote data access --- paper.md | 26 ++++++++++++++++++-------- 1 file changed, 18 insertions(+), 8 deletions(-) diff --git a/paper.md b/paper.md index 15926f1..e7e65f8 100644 --- a/paper.md +++ b/paper.md @@ -11,6 +11,7 @@ authors: orcid: 0000-0001-9262-7860 affiliation: 1 # (Multiple affiliations must be quoted) - name: Ezequiel Cimadevilla + orcid: 0000-0002-8437-2068 affiliation: 2 - name: Wout De Nolf affiliation: 6 @@ -32,7 +33,7 @@ affiliations: - name: NCAS-CMS, Meteorology Department, University of Reading, Reading, United Kingdom. index: 1 ror: 00hx57361 - - name: Institution Name, Spain + - name: Instituto de Física de Cantabria (IFCA), CSIC-Universidad de Cantabria, Santander, Spain. index: 2 - name: TBD index: 3 @@ -48,23 +49,32 @@ bibliography: paper.bib # Summary -Pyfive () is an open-source thread-safe pure Python package for reading data stored in HDF5. While it is not a complete implementation of all the capabilities of HDF5, it includes all the core functionality necessary to read gridded datasets, whether stored contiguously or with chunks, and to carry out the necessary decompression for the standard options (INCLUDE OPTIONS). +Pyfive () is an open-source thread-safe pure Python package for reading data stored in HDF5. While it is not a complete implementation of all the specifications and capabilities of HDF5, it includes all the core functionality necessary to read gridded datasets, whether stored contiguously or with chunks, and to carry out the necessary decompression for the standard options (INCLUDE OPTIONS). +It is designed to address the current challenges of the standard HDF5 library in accessing data remotely, where data is transferred over the Internet from a storage server to the computation platform. Furthermore, it aims to demonstrate the untapped capabilities of the HDF5 format in the context of remote data access, countering the criticism that it is unsuitable for cloud storage. All data access is fully lazy, the data is only read from storage when the numpy data arrays are manipulated. Originally developed some years ago, the package has recently been upgraded to support -lazy access, and to add missing features necessary for handling all the environmental data known to the authors. It is now a realistic option for production data access in environmental science and more widely. +lazy access, and to add missing features necessary for handling all the environmental data known to the authors. It is now a realistic option for production data access in environmental science and more widely. The API is based on that of h5py (which is a python shimmy over the HDF5 c-library, and hence is not thread-safe), with some API extensions to help optimise remote access. # Statement of need -HDF5 is probably the most important data format in physical science, used across the piste.It is particularly important in environmental science, particularly given the fact that NetCDF4 is HDF5 under the hood. +HDF5 is probably the most important data format in physical science, used across the piste. It is particularly important in environmental science, particularly given the fact that NetCDF4 is HDF5 under the hood. From satellite missions, to climate models and radar systems, the default binary format has been HDF5 for decades. While newer formats are starting to get mindshare, there are petabytes, if not exabytes of existing HDF5, and there are still many good use-cases for creating new data in HDF5. -However, despite the history, there are few libraries for reading HDF5 file data that do not depend on the official HDF5 library maintained by the HDFGroup, and in particular, apart from pyfive, in Python there are none that cover the needs of environmental science. -While the HDF5 c-library is reliable and performant, and battle-tested over decades, there are some caveats to depending upon it: Firstly, it is not thread-safe, secondly, the code is large and complex, and should anything happen to the financial stability of The HDF5group, it is not obvious the C-code could be maintained, finally, the code complexity also meant that it was not suitable for developing bespoke code for data recovery in the case of partially corrupt data. From a long-term curation perspective both of these last two constraints are a concern. +However, despite the history, there are few libraries for reading HDF5 file data that do not depend on the official HDF5 library maintained by the HDFGroup, and in particular, apart from pyfive, in Python there are none that cover the needs of environmental science. +While the HDF5 c-library is reliable and performant, and battle-tested over decades, there are some caveats to depending upon it: Firstly, it is not thread-safe, secondly, the code is large and complex, and should anything happen to the financial stability of The HDF5group, it is not obvious the C-code could be maintained. Finally, the code complexity also meant that it was not suitable for developing bespoke code for data recovery in the case of partially corrupt data. From a long-term curation perspective both of these last two constraints are a concern. + +In addition, the paradigm of remote data access has gained traction in recent years due to the advantages it offers, primarily by eliminating the need for file downloads, a task that often consumes significant time for users engaged in data analysis workflows. +This trend has accelerated with the increasing adoption of cloud platforms for storing environmental and climate data, which provide more scalable storage capabilities than those available to many research centers that produce the original datasets. +The combination of remote data access and cloud storage has opened a new paradigm for data access; however, the technological stack must be carefully analyzed and evaluated to fully assess and exploit the performance offered by these platforms. + +In this context, HDF5 has faced challenges in providing users with the performance and capabilities required for accessing data remotely in the cloud, showing relatively slow performance when accessed from cloud storage in a remote data access setting. However, the specific aspects of the HDF5 library responsible for this performance limitation have not been thoroughly investigated. +Instead, the perceived inadequacy of HDF5 has often been superficially justified based on empirical observations of performance when accessing test files. +Pyfive leverages the HDF5 format to provide efficient access to datasets stored in the cloud and accessed remotely, thereby contributing the currently missing knowledge needed to adequately assess HDF5 as a suitable storage format for cloud environments. The original implementation of pyfive (by JH), which included all the low-level functionality to deal with the internals of an HDF5 file was developed with POSIX access in mind. The recent upgrades were developed with the use-case of performant remote access to curated data as the primary motivation, but with additional motivations of having a lightweight HDF5 reader capable of deploying in resource or operating-system constrained environments (such as mobile), and one that could be maintained long-term as a reference reader for curation purposes. The lightweight deployment consequences of a pure-python HDF5 reader need no further introduction, but as additional motivation we now expand on the issues around remote access and curation. -Taking remote access first, one of the reasons for the rapid adoption of pure-python tools like xarray with zarr has been the ability for thread-safe parallelism using dask. Any python solution based on the HDF5 c-library could not meet this requirement, which led to the development of kerchunk mediated direct access to chunked HDF5 data (https://fsspec.github.io/kerchunk/). +Taking remote access first, one of the reasons for the rapid adoption of pure-python tools like xarray with zarr has been the ability for thread-safe parallelism using dask. Any python solution based on the HDF5 c-library could not meet this requirement, which led to the development of kerchunk mediated direct access to chunked HDF5 data (https://fsspec.github.io/kerchunk/). However, in practice using kerchunk requires the data provider to generate kerchunk indices to support remote users, and it leads to issues of synchronicity between indices and changing datasets. pyfive was developed in such a way to have all the benefits of using kerchunk, but without the need for provider support. Because pyfive can access and cache (in the client) the b-tree (index) on a variable-by-variable basis, most of the benefits of kerchunk are gained without any of the constraints. The one advantage left to kerchunk is that the kerchunk index is always a contiguous object accessible with one get transaction, this is not necessarily the case with the b-tree, unless the source data has been repacked to ensure contiguous metadata using a tool like h5repack. However, in practice, for many use cases, b-tree extraction with pyfive will be comparable in performance to obtaining a kerchunk index, and completely opaque to the user. @@ -72,7 +82,7 @@ However, in practice, for many use cases, b-tree extraction with pyfive will be The issues of the dependency on a complex code maintained by one private company in the context of maintaining data access (over decades, and potentially centuries), can only be mitigated by ensuring that the data format is well documented, that data writers use only the documented features, and that public code exists which can be relatively easily maintained. The HDF5group have provided good documentation for the core features of HDF5 which include all those of interest to the weather and climate community who motivated this reboot of pyfive, and while there is a community of developers beyond the HDF5 group (including some at the publicly funded Unidata institution), recent events suggest that given most of those developers and their existing funding are US based, some spreading of risk would be desirable. To that end, a pure-python code, which is relatively small and maintained by an international constituency, alongside the existing c-code, provides some assurance that the community can maintain HDF5 access for the foreseeable future. -A pure python code also makes it easier to develop scripts which can work around data and metadata damage should they occur. +A pure python code also makes it easier to develop scripts which can work around data and metadata damage should they occur. # Examples From 6ab0fd809c54f2e5838aa4afd8d7cb4c58dbf96e Mon Sep 17 00:00:00 2001 From: valeriupredoi Date: Mon, 29 Sep 2025 14:40:55 +0000 Subject: [PATCH 25/28] (auto) Paper PDF Draft --- paper.pdf | Bin 217574 -> 219933 bytes 1 file changed, 0 insertions(+), 0 deletions(-) diff --git a/paper.pdf b/paper.pdf index 29284fc926982dc561d47328db221be88f3fd003..bf9a78d7cda73a55968b5cbf0771989a92577a38 100644 GIT binary patch delta 29475 zcmV)9K*hi2qYa(54Y2kKmLCHs1UN7-G?%|g0~LQg$&M_!argHX^#hgSz5tB|>h&U6 zfDdC0po5@O8?s^a*pM&!eMbbzV33(vUCYD34=8A!s*}kzA{aZF>Y(6%|N9^GqYnS} z$8Vbc&<7p#VzoOMtrwro;p4Y&|M<2<6;(depX2z5?Vy%g(xLssj>V(s{@D6IiUGd= z`t5%Y@7lV9c4|eV_-Qml#^{AO7VxeR%yJ81dYgmz4B* zrA4`LIL4?JGeI&gMthjl0LieV;0_@JQlfuukhEGUe^Re608I~&bU`Wo{rTveLpYn~ zqqP?P@>mbvd0XnJH!OQL>51Aa4;XP7e&LmSZ>>x&xI!H1z1 z1$wnP`NKaCSc(5rOYkaZ+_oyhYa}e|T^V=#70dzY5U_kWIv7`Jd-(0p%fe!u3g*y$ zkL^vX%mp8ZZ+eM2%SyOf?t&g#vyXoRLFU++v|lW2b?|SfC)@M9TK(1Jp}~J1zWx31 z1>k=nfN7)*d|Up2a$rl3W5j05A-|DgZCwvQJTF7MGwt71gF2MKC+%rZUkR z%-Allos8qwFs@r7jFDxB9`}*wlCXFk4@bM$XtimNZqXq|S71jaegQ@S^>Kel9X*Zh zwMHyP;KQL8e2AH}vd{JG+MKhp87n#stc<1{pu=87Q;s2fE(wUINVD|GSothwUCUtD zY#i`z;P?uDVfbuRiZJisl8L?GqtB)leXb^0W(^2PK53$%WOGF^mt`MtXlgcpD>J3lf1eKu|a2n|^9 z$i`J?*(e56Wz+9fRK@yy;##_vey=Rwlp5aE@>BT-%>M^6cpC%g8vcL5;2#YB!QdYZ z{%2$GjeT9n;BA8Hu#}0x+bE@t=*0H}-WQ7Y8a@LYkR){DO(Qlz|fLzLsu^-p%^9x!HL%jG)gs zp~k5ykY#E14LM*_wmW|*L!G5A|B4MkcEpc#`zWA(2XfNGc8U*y@(?Hwf$|V2Kat<3 z@~@*{U}qga8tMbddb4<_@s;C8@@b>fl7K%?e7eY$fE+tjt^cKRZc~C2-K`%gUuRza zz1k6)$KSSQG?1-Ht7*FnrfqdzoI5k?8iYVeIL-9C2tcUzcI|(s`muosr;#%KLn1vS z(nBIWB+}1k;#B^1sYG(dP=dhB+x-Q+-I=&xIAWK#=gPIC zZpvY@u=SJU6fl2RVj?ufQr zn&kj99-2iUM!RZeK%M|hO0>q6lwo>)tIw~TCj3^DfLnhuu&Rm0O%lD<--OA=+^W^q zBvyM1EU!IM4wsi>*;vCLNKbKUO7;oGvr@NMm4__kCr*xYb6zOLhI zkIWf<9f+3I_!^j?a}gPpw$_kr0cBL9RK&7utww+C)IoPBeXR{HlDZmmGEm@y0Z@HV ztLS1tQ3q^NWvrB}$|wv0hh9G0%vJ)pq(F0tumGSu1O%cv zE>IDzCXnT*yhQ8)kOfoKcrJ#N8IV{QcL9IYXdMbn=`lr*&;n7VG(Ugf?f?MlUIdGT zsax&=2*AXwpTpr05p0&+5pR7ZMN6=D=M%O6If@s$NYa%x4;Sh-BMfFfW68 zD&SdTt~#JUBVog@MdcHfbzi5IfS&~@(K#i8j)7SMDxJ@fs1f!qfWRU-5ivR-3kyXa zDux4*b4GOAkh~>|&)CBF;Cmq;f$Rf~pSDh9FYpJ00Xa|%0#3-HfHx6lVFMt` zGPxij`iy#kb+{K0;$R9kUWi44lrj`$y-^~F67(OSZ!?fCx&jofpi?-2M#!`9OcxCT&)bw>V}_$REJ2@fZb$XXv`_UBn6!NY+u&unF0x z17;Knof`BuP0x6;keYzeM7sh&8d2NJ$z^JibVe;BWyD*1{;2ylTQ2(SMILQMRg1ER zQDhN}<$wco5t558&)O3C7??dhqk>vj1YC8uGmIk%RfKiHw zh@cxFo&YWQIAXHcjzIsYFQ8b6!4*Zygk%!2{cLg5fb>+vWN2qZgq9*E4-BhpI#4yJ zg;gXNK%{77WOQ&9S$u!ahW3X+rHWdBCgZRLm?gStB*<%&j^yD0X_@*naRMM?5N3Wl41)^2MA_M@iXbp?0~jJ|0=37jLJC>IMtd&K zI*W#SuTl_NduS*ZLm*Wkq-ho&MSCVO(`MPos;>hH&$!GBZG?&IL4jFGS3oL)PN)fW z1(@(`QR!;H?$3XWk6u(z*1ISuo%ToBG^q2c0uknl8eOl3nIfvdsbUAYB0d8@3z98D z8JNzw^F>sXO}2>{qelNND!zgp|AN1S9T`Ze=MTuDR_HwKAo4IpfoLn41bU;>gwA_zgP?K~0-LL!G| zVUh@V?W5q5WPX4&VLpikiHMi@WPfBn*^3IFq%InlT%q}gt2%1XjpTiI>G;sjemA#HIq}X;9?zNkI7Rk_T{#8RWV;?!wyy}9Cyqng!8_mzvxwXyv@ z^Bf#uTP@z@?ErJ_;`Hkdvg#1qCnPY|&5X2unrIu>V8j6>&8@62=R}SFVn_%37$x{L zsJoeVr;g&Kw2P6-Fwrk)*IK3U|HSH~SC(^&cH#D+qkCgA0AT!6EEg(rBpn zK)AYsQ-_;#eYJ&#-HyvUe(CbI4PtVRs_p>p`yLm!Z-=03ueIkJDR#zAx|Q4dq(}}l zT%~`$DsuHV-f?qg{VM39|^!50eBx+*GUjY z7R^?hg(C?vieP5ccTrN%O0^pizV4x%#6zeX-WEYLiH0PuYIzsY|JQm2%1BO&*q8D0w$mzS92ML~plN2g{BzJ0s)rstSDd+i=~z$4IyYC!|H z4c#ZR7rnd%5e#<>ve;>;E{|g8+&q9+oIhgvRSC2P?A^Cwj&jQZp?pw z{3Z$=SP$7$cTH9$hBB3uU$RlkOSe^Yq%z70_zS7-6y8^bITNh z>(#bfwm)0#Pcf4(&9F+FM?su?dDxj9YVd5m|6O+IFjU{6O|r7Gbz<|X$Nx|FZrzOO zH-QoYF`weGbst;z|IOB|w0RW7dCAsQ@Xp%bW$O+@kt)>^tiF^lB5@ zIkRN%?v(PAJRduyyARh+uJ?Kr{@U&SB?Ljsv2MJr*p@?&I9}s&-t>bh6?(g{ia>dJ z?ik%J+DOjDF2yiq7qbVA+%+fkYD&-H`Q>05Vd~8KO)TeBm!m64FI|5QpdRy^#-4ri z+0|>C*>88My_s44cJ|!LHaYF|KzC^b3tQz3;yFh+NbrOrGk__Xgo0uad4_ zCE7CE&i57uB5KS}(%0R*+0BK?aix=tMUXqIkaO|BpG1r*)rk}!%`k~ZI+1$FYIV)^ zYxe|~kO$ZB4HI0Fnz(-!9@Q6q8|JVW2jFTz6qst5rWt@^#mInmpME&IW%PM)w+Xo95BUlP`lH zcx#G^(QF1+tY1P(D<=EB-EiBzyFT9R%^wH(LdIoa9+;zv9W6@5dBy;9Osw9$#2z87 zF2(UMLe7gv*Zep_VFUG_E|jFd7k9j_V%wkkttu_-rry`r-S=HD&UCmMAbjsMO|Je* zxw?h~neIamRBC^<14_9r8!*)}&FfO92B{($_=%%d>Pg7^EaW|X0l-Z%-$~#zBcA}! 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279 zcmbQcjd$)g-i9rVzjp8&8t57rhZveznOIsGSw>CI-^nO3-E$fv_ja9~j7-dYsPfZo z_Au(9i&gAlG(Z#EzHJYq1fz{J`oeNXx$P>E%s&|cW+F|B delta 279 zcmbQcjd$)g-i9rVzjp8&Sn3*Ch8UVynHX4^m_|*{-^nO3-E$fv_ja9~j7-dYsPfZo z_Au(9i&gAlG(Z#EzHJYq1fz<1nt7U0Qj(djQIesBt_hH-n`CC52I8g|rkJOtn46lk zf7;8q{nK8ib(7Q$ER8G;O-u}c?$A`w_svgnNi0cK&~ULbGB7elNNztK!2FZl&B?{c z+0ohD#MH^q*v-_@(%IC>z|zv$$kEx!!o Date: Fri, 3 Oct 2025 16:01:57 +0100 Subject: [PATCH 27/28] add use examples --- paper.md | 32 +++++++++++++++++++++++++++++++- 1 file changed, 31 insertions(+), 1 deletion(-) diff --git a/paper.md b/paper.md index 0495660..39da0af 100644 --- a/paper.md +++ b/paper.md @@ -89,7 +89,37 @@ A pure python code also makes it easier to develop scripts which can work around A notable feature of the recent pyfive upgrade is that it was carried out with thread-safety and remote access using fsspec (filesystem-spec.readthedocs.io) in mind. We provide two examples of using pyfive to access remote data, one in S3, and one behind a modern http web server: -v.predoi@ncas.ac.uk When we have this is markdown, can you please put two python examples in here as above! +For accessing the data on S3 storage, we will have to set up an ``s3fs`` virtual file system, then pass it to Pyfive: + +```python +import pyfive +import s3fs + + +# storage options for an anon S3 bucket +storage_options = { + 'anon': True, + 'client_kwargs': {'endpoint_url': "https://s3server.ac.uk"} +} +fs = s3fs.S3FileSystem(**storage_options) +file_uri = "s3-bucket/myfile.nc" +with fs.open(file_uri, 'rb') as s3_file: + nc = pyfive.File(s3_file) + dataset = nc[var] +``` + +for an HTTPS data server, the usage is similar: + +```python +import fsspec +import pyfive + + +fs = fsspec.filesystem('http') +with fs.open("https://site.com/myfile.nc", 'rb') as http_file: + nc = pyfive.File(http_file) + dataset = nc[var] +``` # Mathematics From 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