CCL: DropBox / GitHub / etc for ESI



 Sent to CCL by: "N. Sukumar" [nagams|rpi.edu]
 
The twin problems of ensuring data integrity and data longevity are non-trivial. Any solution has to make long-term economic sense. With the proliferation of pay-to-publish journals, I'm not sure of the longevity of the articles themselves, let alone the supplementary data. In a pay up-front model, how does the publisher ensure support for the data "in perpetuity"? It is no surprise that publishers may want the authors' institutions to support the ESI, even when the authors transfer the article copyright to the publisher. But what happens when the author moves to another institution or to industry or retires? Will the author's former institution continue to support the data repository "in perpetuity"?
 --
 N. SUKUMAR
 Professor & Head, Department of Chemistry
 Director, Center for Informatics
 Shiv Nadar University, India
 On 2015-04-24 22:45, James Buchwald buchwj],[rpi.edu wrote:
 
 Sent to CCL by: James Buchwald [buchwj-.-rpi.edu]
 I think one of the challenges for such an approach will be long-term
 availability of the ESI data.  The current model of "publisher hosts
 the ESI" has the advantage that the publisher is responsible for
 ensuring that the data continues to be available for as long as the
 article is available.  Moving to an external host could (would?) lead
 to situations where the site goes out of business/suffers
 irrecoverable data loss/etc and the ESI is potentially lost (and then
 you get broken links in the original paper).
 Obviously this is less of a potential issue (in the short term) for
 large sites such as GitHub, but there is still a question of how such
 methods will persist in the long (30+ years) term.  I think there is a
 need for publishers to develop their own new ESI storage and retrieval
 mechanisms for large data sets, etc., such that the publisher can
 ensure the long-term availability of the data on the same timeframe as
 the manuscript itself.
 Best,
 James
 On 04/24/2015 09:51 AM, Brian Skinn bskinn(_)alum.mit.edu wrote:
 
 CCL-ers,
 
Provision of sufficient electronic supplementary information for published articles (molecular geometries, etc.) appears to be an ongoing challenge for computational chemists. All too often there are interesting results worth repetition and/or extension, but which are challenging to perform because the source computational files are unavailable. Further, the current journal-site-based ESI publication model is quite confining, as (I assume?) there are size limitations on what publishers wish to host on their servers.
 
So, an idea for discussion: What about posting ESI on third-party services such as Dropbox, Github, etc? ESI is meant to be public information, so security needs are minimal. Such services are well equipped to handle the file transfer loads that ESI would likely represent, and storage costs would either be nil, or comparatively small. Further, it would be possible to deposit binary files (wavefunction information, electron density files, etc.) that might be of significant use to outside researchers wishing to analyze, repeat and/or extend a given work.
 Pros? Cons?  I'm curious what you all think.
 Best regards,
 Brian
 
 --
 James R. Buchwald
 Graduate Student, Dept. of Chemistry and Chemical Biology
 Rensselaer Polytechnic Institute
 Graduate Research Assistant, Dinolfo Laboratory
 
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