Re: RDF for molecules, using InChI

2007-09-19 Thread Egon Willighagen
Hi all, I have not applied all suggestions sent my people on the list, but wanted to give a short update. So, no RDF document pointing to all molecules with non-trivial RDF statements, and no RDF-based definitions of the properties used. Apologies for that. On 8/2/07, Egon Willighagen <[EMAIL PR

Re: RDF for molecules, using InChI

2007-08-21 Thread Egon Willighagen
Hi Eric, On 8/21/07, Eric Neumann <[EMAIL PROTECTED]> wrote: > My question (without knowing the true scale of what you had) was simply to > see if a mechanism existed that told me "which molecules at OpenMolecules > are URI-resolvable as RDF?". There is no such list yet, but will put creating on

RE: RDF for molecules, using InChI

2007-08-21 Thread Eric Neumann
al Message- From: Egon Willighagen [mailto:[EMAIL PROTECTED] Sent: Tue 8/21/2007 3:40 AM To: Eric Neumann Cc: public-semweb-lifesci@w3.org Subject: Re: RDF for molecules, using InChI Eric, On 8/18/07, Egon Willighagen <[EMAIL PROTECTED]> wrote: > On 8/17/07, Eric Neumann <[EMAIL PR

Re: RDF for molecules, using InChI

2007-08-21 Thread Egon Willighagen
Eric, On 8/18/07, Egon Willighagen <[EMAIL PROTECTED]> wrote: > On 8/17/07, Eric Neumann <[EMAIL PROTECTED]> wrote: > > Thanks for the pointer-- is there a list of all the molecules you store > > something about? > > Not at this moment. That would be a rather lengthy RDF doc. The number > of mol

Re: RDF for molecules, using InChI

2007-08-18 Thread Egon Willighagen
Hi Eric, On 8/17/07, Eric Neumann <[EMAIL PROTECTED]> wrote: > Thanks for the pointer-- is there a list of all the molecules you store > something about? Not at this moment. That would be a rather lengthy RDF doc. The number of molecules of which something is know is currently in the order of 1

RE: RDF for molecules, using InChI

2007-08-17 Thread Eric Neumann
15 AM To: public-semweb-lifesci@w3.org Subject: Re: RDF for molecules, using InChI Hi all, On 8/2/07, Egon Willighagen <[EMAIL PROTECTED]> wrote: > 1.http://cb.openmolecules.net/rdf/?InChI=1/CH4/h1H4 a quick update, rdf.openmolecules.net is now online, so the above URL

Re: RDF for molecules, using InChI

2007-08-17 Thread Egon Willighagen
Hi all, On 8/2/07, Egon Willighagen <[EMAIL PROTECTED]> wrote: > 1.http://cb.openmolecules.net/rdf/?InChI=1/CH4/h1H4 a quick update, rdf.openmolecules.net is now online, so the above URL becomes: http://rdf.openmolecules.net/?InChI=1/CH4/h1H4 Egon http://chem-bla-ics.blogspot.com/

Re: RDF for molecules, using InChI

2007-08-09 Thread Xiaoshu Wang
Alan Ruttenberg wrote: I'm not a fan of frag ids because the establish anarchic behavior seems impossible to change, and even with the use of it, at least insofar as the practice of having a single document being returned for multiple fragids and then having to fish out the relevant portion g

Re: RDF for molecules, using InChI

2007-08-09 Thread Xiaoshu Wang
Alan Ruttenberg wrote: The W3C use of "representation" doesn't make sense to me. So it's hard for me to get past a sentence that uses that concept. I tend to think that: Thing = what is referenced by a URI, let's labeled it like T(uri) representation = what is returned when a URI is dereferenc

Re: RDF for molecules, using InChI

2007-08-08 Thread Alan Ruttenberg
On Aug 7, 2007, at 7:29 AM, Xiaoshu Wang wrote: Alan, I'm still waiting for an example that *can't* be solved using a HTTP scheme. Do you have any? So far the best I have is that LSIDS point to two "forks", the data and the metadata (meaning of these not clear, btw). However I've already

RE: RDF for molecules, using InChI

2007-08-08 Thread Chimezie Ogbuji
On Mon, 2007-08-06 at 14:59 -0400, Booth, David (HP Software - Boston) > What has caused this thinking to shift more recently is the realization > that: (1) HTTP URIs can be used as globally unambiguous names (or > "identifiers") of things other than web pages (or "information > resources"); and

RE: RDF for molecules, using InChI

2007-08-07 Thread Booth, David (HP Software - Boston)
> From: Chimezie Ogbuji > [ . . . ] > Well, it's one thing to be neutral wrt schemes and another to > make a statement about the use of certain schemes (HTTP) as > preferred for authors who are in the business of minting URIs. > I'll just echo Michel's sentiments about not alienating > communities

Re: RDF for molecules, using InChI

2007-08-07 Thread Xiaoshu Wang
Chimezie Ogbuji wrote: The HTTP scheme: http_URL = "http:" "//" host [ ":" port ] [ abs_path [ "?" query ]] Does not have any formal components for identify management (dates and versions). A person (or group) who may not have control over webspace but has a coherent theory they wish to expre

Re: RDF for molecules, using InChI

2007-08-07 Thread Chimezie Ogbuji
On Mon, 2007-08-06 at 17:20 -0400, Alan Ruttenberg wrote: > Second, the view offered was my own and was perhaps too strongly > stated. But I made it because I saw that recommendations were being > made about decisions related to URIs and because I felt that given > that we have an ongoing ac

Re: RDF for molecules, using InChI

2007-08-07 Thread Xiaoshu Wang
Alan, I'm still waiting for an example that *can't* be solved using a HTTP scheme. Do you have any? So far the best I have is that LSIDS point to two "forks", the data and the metadata (meaning of these not clear, btw). However I've already given an existence proof, in the way of a proposed i

Re: RDF for molecules, using InChI

2007-08-06 Thread Alan Ruttenberg
Summary: Recapping some issues for Chimezie - may not be of interest to those who have been following the discussion already. Bottom line: If you are interested in URI issues, please talk to Jonathan Rees who is responsible for editing the recommendations documents that we (HCLS) have agre

RE: RDF for molecules, using InChI

2007-08-06 Thread Booth, David (HP Software - Boston)
se. > -Original Message- > From: [EMAIL PROTECTED] > [mailto:[EMAIL PROTECTED] On Behalf Of > Chimezie Ogbuji > Sent: Monday, August 06, 2007 9:09 AM > To: Alan Ruttenberg > Cc: Egon Willighagen; public-semweb-lifesci hcls; > Michel_Dumontier; Jonathan A Rees > S

Re: RDF for molecules, using InChI

2007-08-06 Thread Xiaoshu Wang
Chimezie Ogbuji wrote: On Sun, 2007-08-05 at 01:25 -0400, Alan Ruttenberg wrote: I don't think it is likely that the HCLS recommendations will suggest using INFO uri's. Is the 'recommendation' of a particular URI scheme over others on the agenda? I would hope not. I've yet to under

Re: RDF for molecules, using InChI

2007-08-06 Thread Chimezie Ogbuji
On Sun, 2007-08-05 at 01:25 -0400, Alan Ruttenberg wrote: > I don't think it is likely that the HCLS recommendations will suggest > using INFO uri's. Is the 'recommendation' of a particular URI scheme over others on the agenda? I would hope not. I've yet to understand the motivation for consi

Re: RDF for molecules, using InChI

2007-08-04 Thread Alan Ruttenberg
ogy and Training Center Mailing: 209 Nesbitt, 1125 Colonel By Drive, Ottawa, ON K1S5B6 Tel: +1 (613) 520-2600 x4194 Fax: +1 (613) 520-3539 Web: http://dumontierlab.com Skype: micheldumontier -Original Message- From: Egon Willighagen [mailto:[EMAIL PROTECTED] Sent: Friday, August 03

RE: RDF for molecules, using InChI

2007-08-03 Thread Michel_Dumontier
1125 Colonel By Drive, Ottawa, ON K1S5B6 Tel: +1 (613) 520-2600 x4194 Fax: +1 (613) 520-3539 Web: http://dumontierlab.com Skype: micheldumontier > -----Original Message----- > From: Egon Willighagen [mailto:[EMAIL PROTECTED] > Sent: Friday, August 03, 2007 6:15 AM > To: Michel_Dumontier

Re: RDF for molecules, using InChI

2007-08-03 Thread Alan Ruttenberg
Hi Egon, A minor point: You've created URIs such as http://pubchem.ncbi.nlm.nih.gov/#297 and http://pubchem.ncbi.nlm.nih.gov/#cid Generally, it is considered better to mint URIs in a namespace you control or with which you have an agreement. Have you worked with Pubchem and do they sanc

RE: RDF for molecules, using InChI

2007-08-02 Thread Booth, David (HP Software - Boston)
> From: Michel_Dumontier > > I support the use of InChI as URI. Of course, the use of such > a URI will annoy those that want URL resolvable URIs... another > reason to relate the URI and the resolvable URL with an > owl:sameAs predicate. Can you clarify? I see that an HTTP GET on http://cb.

RE: RDF for molecules, using InChI

2007-08-02 Thread Michel_Dumontier
@w3.org Subject: RE: RDF for molecules, using InChI Certainly url-encoding solves this format problem, but it would indeed be nice to eventually settle on a format not requiring encoding so that its wysiwyg for the human... -Eric -Original Message- From: Michel_Dumontier [mailto

RE: RDF for molecules, using InChI

2007-08-02 Thread Eric Neumann
Neumann; Michel_Dumontier; Egon Willighagen; public-semweb-lifesci@w3.org Subject: RE: RDF for molecules, using InChI Correct me if I'm wrong, but I don't think InCHI is URI compliant [1] (=, /) so we'll have to escape or use some encoding scheme. -=Michel=- [1] http://www.i

RE: RDF for molecules, using InChI

2007-08-02 Thread Michel_Dumontier
Sent: Thursday, August 02, 2007 4:08 PM To: Michel_Dumontier; Egon Willighagen; public-semweb-lifesci@w3.org Subject: RE: RDF for molecules, using InChI Michel, For clarity sake, can you give an example of your InChi URI ? urn?? Eric -Original Message- From: Michel_Dumontier

RE: RDF for molecules, using InChI

2007-08-02 Thread Eric Neumann
Michel, For clarity sake, can you give an example of your InChi URI ? urn?? Eric -Original Message- From: Michel_Dumontier [mailto:[EMAIL PROTECTED] Sent: Thu 8/2/2007 3:59 PM To: Eric Neumann; Egon Willighagen; public-semweb-lifesci@w3.org Subject: RE: RDF for molecules, using InChI

RE: RDF for molecules, using InChI

2007-08-02 Thread Michel_Dumontier
; public-semweb-lifesci@w3.org Subject: RE: RDF for molecules, using InChI Egon, I commend you on two fronts: 1) developing a chem data model that utilizes InChi as part of the URI, and 2) demonstrating how something as simle as an XSLT can be used to organize viewable html ( I also see your O

RE: RDF for molecules, using InChI

2007-08-02 Thread Eric Neumann
Egon, I commend you on two fronts: 1) developing a chem data model that utilizes InChi as part of the URI, and 2) demonstrating how something as simle as an XSLT can be used to organize viewable html ( I also see your OpenMolecules page supports the use of RDFa-- great job!). We've discussed