Yearly Archives: 2008

CrystalEye links in Chemspider

I have agreed to review the CrystalEye data in Chemspider and before reading this post you should read the background carefully ( CrystalEye and Chemspider). The main points are that Crystaleye was not designed to be redistributable and that the … Continue reading

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CrystalEye and Chemspider

Chemspider (Antony Williams) has asked on his blog for feedback on CrystalEye and shall respond in some detail. I shall try to exclude any personal judgment and not make statements about the value of the process. In essence it will … Continue reading

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Open data is essential for science

An important set of papers on Open Data and science: The June issue of the Journal of Science Communication is now available (Peter Suber) . OA-related articles: Alessandro Delfanti, Collaborative Web between open and closed science Bora Zivkovic, The future … Continue reading

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CrystalEye – an example of a data repository

I shall be writing a number of posts about (chemical) crystallography – which may be of wider interest to those interested in data quality assessment, robotic harvesting, robotic calculation, hyperlinking, repositories and the free access to scientific data. I’ll start … Continue reading

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Update and emphasis on publishing and Crystallography

I have been off air for a week part of which is because we have been concentrating on crystallography. The next few posts will cover various aspects of this subject – but there are many which are general enough that … Continue reading

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Naming things

Two things from today – a presentation by one of my colleagues (revealed later) on “Naming things” – or a similar title – which isn’t yet public and they’ll be giving at a meeting next week. I won’t give it … Continue reading

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Chemical names and structures continued

Antony Williams, Rich Apodaca and I have been having a debate on our blogs about how to identify chemicals (I choose this word so as not to be too specific) to a machine. Antony has a long and detailed response … Continue reading

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There is no “right structure” for a compound

A few days ago I promise d to respond to Antony Williams’ post on associating chemical names with structures. I wrote: There is no “right structure (sic)” for a compound. There are structures which have a very high probability of … Continue reading

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Don't "use Institutional Repositories"; "put it on the web"

A very thoughtful post by Cameron Neylon about a very thoughtful talk by Andy Powell about why institutional repositories don’t work and in their current form won’t work. I’ll post snippets and comment: The trouble with institutional repositories 20:52 10/06/2008, … Continue reading

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ICE-TheOREm – Authoring theses has never been easier

Peter Sefton and ourselves are teaming up. ICE is the Integrated Content Environment for authoring semantic documents. Peter’s been working on this and it’s now becoming an important factor. With the ODT/OOXML arena in many people’s minds groups like Peter … Continue reading

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