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cheminf-ontology
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Gang Fu
, …
Janna Hastings
23
8/4/16
physical properties in CHEMINF
Hi Gang, I'm going to have to defer to Egon (CC'ed) on this one -- hopefully he can add them?
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physical properties in CHEMINF
Hi Gang, I'm going to have to defer to Egon (CC'ed) on this one -- hopefully he can add them?
8/4/16
Egon Willighagen
3/26/16
new CHEMINF release?
Hi Janna, since our 1.0 release there have been numerous small additions and fixed. It seems to me
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new CHEMINF release?
Hi Janna, since our 1.0 release there have been numerous small additions and fixed. It seems to me
3/26/16
Gang Fu
5/21/15
adding UN numbers identifying hazardous substance
Hi, Can we add UN numbers that identify hazardous substance? We have thousands of compounds having UN
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adding UN numbers identifying hazardous substance
Hi, Can we add UN numbers that identify hazardous substance? We have thousands of compounds having UN
5/21/15
Gang Fu
,
Egon Willighagen
3
4/27/15
adding NIOSH RTECS as chemical database identifier
Thank you very much, Egon! On Mon, Apr 27, 2015 at 2:21 PM, Egon Willighagen <egon.willighagen@
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adding NIOSH RTECS as chemical database identifier
Thank you very much, Egon! On Mon, Apr 27, 2015 at 2:21 PM, Egon Willighagen <egon.willighagen@
4/27/15
Egon Willighagen
, …
Michel Dumontier
5
3/17/15
moving the repository
that's great - so now somebody has to change the purl http://purl.obolibrary.org/obo/cheminf.owl
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moving the repository
that's great - so now somebody has to change the purl http://purl.obolibrary.org/obo/cheminf.owl
3/17/15
Michel Dumontier
,
Egon Willighagen
2
1/9/15
Re: Property or class? cheminfo ontology.
Hi Stian, We recently had this discussion too, and then it was said to be intended use from a CHEMINF
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Re: Property or class? cheminfo ontology.
Hi Stian, We recently had this discussion too, and then it was said to be intended use from a CHEMINF
1/9/15
Janna Hastings
, …
Michel Dumontier
12
7/23/14
Migrate CHEMINF to BFO 2?
Hi Michel and Egon, the simplest way for you to see the proposed changes without my committing them
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Migrate CHEMINF to BFO 2?
Hi Michel and Egon, the simplest way for you to see the proposed changes without my committing them
7/23/14
Egon Willighagen
,
Janna Hastings
2
7/9/14
why again cheminf.owl and cheminf-core.owl?
Hi Egon, I think this was as a result of a failure of the modularisation strategy adopted a while
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why again cheminf.owl and cheminf-core.owl?
Hi Egon, I think this was as a result of a failure of the modularisation strategy adopted a while
7/9/14
Egon Willighagen
, …
Janna Hastings
6
7/9/14
CAS registry number and PubChem CID/SID?
Great, thanks Egon! Janna On Wed, Jul 9, 2014 at 11:57 AM, Egon Willighagen <egon.willighagen@
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CAS registry number and PubChem CID/SID?
Great, thanks Egon! Janna On Wed, Jul 9, 2014 at 11:57 AM, Egon Willighagen <egon.willighagen@
7/9/14
Egon Willighagen
,
Gang Fu
2
5/5/14
BODO-CHEMINF alignment
Hi Egon, I looked at CHEMINF, and found the TPSA is a subclass of "surface area descriptor"
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BODO-CHEMINF alignment
Hi Egon, I looked at CHEMINF, and found the TPSA is a subclass of "surface area descriptor"
5/5/14
Janna Hastings
5/10/13
RE: CHEMINF Properties
Hi Mark, yes, sure, I'll get those in for you in the next day or two. Cheers, Janna -----Original
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RE: CHEMINF Properties
Hi Mark, yes, sure, I'll get those in for you in the next day or two. Cheers, Janna -----Original
5/10/13
Gang Fu
, …
Michel Dumontier
9
2/4/13
PubChem Relational Properties and Relationship Hierarchy
Hi Michel, This is very good suggestion! Thank you very much! Best, Gang On Thu, Jan 10, 2013 at 10:
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PubChem Relational Properties and Relationship Hierarchy
Hi Michel, This is very good suggestion! Thank you very much! Best, Gang On Thu, Jan 10, 2013 at 10:
2/4/13
Gang Fu
2
12/11/12
PubChem chemical properties and software description
The software libraries used in PubChem have been updated recently (2012-11-26). Here is the file
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PubChem chemical properties and software description
The software libraries used in PubChem have been updated recently (2012-11-26). Here is the file
12/11/12
Egon Willighagen
,
Janna Hastings
12
11/8/12
CHEMINF / CHEBI entry to use for chemical entity classes?
I think what you're trying to do confuses the subclass hierarchy with a bit of knowledge that
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CHEMINF / CHEBI entry to use for chemical entity classes?
I think what you're trying to do confuses the subclass hierarchy with a bit of knowledge that
11/8/12
Michel Dumontier
3/5/12
Bio-Ontologies SIG 2012 -- 39 days to submission deadline
What: Call for participation in the Bio-Ontologies SIG 2012 Where: July 13 - 14, 2012, Long Beach, CA
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Bio-Ontologies SIG 2012 -- 39 days to submission deadline
What: Call for participation in the Bio-Ontologies SIG 2012 Where: July 13 - 14, 2012, Long Beach, CA
3/5/12
Cord Wiljes
, …
Michel Dumontier
14
2/22/12
Introduction
Hi Cord, SIO provides predicates to describe finer mereological relationships, like that between a
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Introduction
Hi Cord, SIO provides predicates to describe finer mereological relationships, like that between a
2/22/12
Michel Dumontier
, …
Janna Hastings
4
2/9/12
axiom?
I sort of remember that axiom. We wanted to link descriptors to qualities or realizables of molecular
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axiom?
I sort of remember that axiom. We wanted to link descriptors to qualities or realizables of molecular
2/9/12
Michel Dumontier
, …
Janna Hastings
3
11/18/11
Re: Contributing to CHEMINF
Welcome on board Ola, and thanks very much for your contributions! Janna On Fri, Nov 18, 2011 at 5:35
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Re: Contributing to CHEMINF
Welcome on board Ola, and thanks very much for your contributions! Janna On Fri, Nov 18, 2011 at 5:35
11/18/11
Egon Willighagen
, …
Michel Dumontier
18
10/16/11
Re: BODO - CHEMINF alignment
On Sun, Oct 16, 2011 at 11:25 AM, Egon Willighagen <egon.wil...@gmail.com> wrote: On Sun,
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Re: BODO - CHEMINF alignment
On Sun, Oct 16, 2011 at 11:25 AM, Egon Willighagen <egon.wil...@gmail.com> wrote: On Sun,
10/16/11
Egon Willighagen
,
Michel Dumontier
2
10/9/11
dimensionality extent quality?
On Sun, Oct 9, 2011 at 7:43 AM, Egon Willighagen <egon.wil...@gmail.com> wrote: Hi all, I
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dimensionality extent quality?
On Sun, Oct 9, 2011 at 7:43 AM, Egon Willighagen <egon.wil...@gmail.com> wrote: Hi all, I
10/9/11
Michel Dumontier
7/15/11
Ontologies Come of Age OCAS at ISWC2011
http://ocas.mywikipaper.org The real challenge for Semantic Web technologies and ontologies lays in
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Ontologies Come of Age OCAS at ISWC2011
http://ocas.mywikipaper.org The real challenge for Semantic Web technologies and ontologies lays in
7/15/11
Michel Dumontier
7/7/11
CFP : Special Issue on Community-Driven Curation of Ontologies and Knowledge Bases in HealthCare and Life Sciences
[Apologies for cross-posting] =================================================== CALL FOR PAPERS
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CFP : Special Issue on Community-Driven Curation of Ontologies and Knowledge Bases in HealthCare and Life Sciences
[Apologies for cross-posting] =================================================== CALL FOR PAPERS
7/7/11
Egon Willighagen
,
Michel Dumontier
2
5/18/11
Drug a role or entity?
Hi Egon, (adding this to SIO's mailing list) admittedly, while I'm working on a theory of
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Drug a role or entity?
Hi Egon, (adding this to SIO's mailing list) admittedly, while I'm working on a theory of
5/18/11
Egon Willighagen
, …
Janna Hastings
4
12/6/10
a CDK descriptor as OWL
Hi Leo, all, Egon's version might be perhaps slightly closer to the current version of the paper
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a CDK descriptor as OWL
Hi Leo, all, Egon's version might be perhaps slightly closer to the current version of the paper
12/6/10
Egon Willighagen
, …
Michel Dumontier
7
11/4/10
domains and ranges for object properties?
On Thu, Nov 4, 2010 at 10:50 AM, Egon Willighagen <egon.wil...@gmail.com> wrote: > On
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domains and ranges for object properties?
On Thu, Nov 4, 2010 at 10:50 AM, Egon Willighagen <egon.wil...@gmail.com> wrote: > On
11/4/10
Egon Willighagen
,
Janna Hastings
2
10/21/10
Fwd: NDR-RT (US inter-agency drug compound taxonomy)
Hi Egon, I had once tried to investigate them in order to link up with ChEBI, but back then I was not
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Fwd: NDR-RT (US inter-agency drug compound taxonomy)
Hi Egon, I had once tried to investigate them in order to link up with ChEBI, but back then I was not
10/21/10
Egon Willighagen
, …
Michel_Dumontier
8
10/18/10
Fwd: [OTDev] Errors and warnings in datasets
On Wed, Oct 13, 2010 at 11:23 AM, Janna Hastings <janna.h...@gmail.com> wrote: > <
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Fwd: [OTDev] Errors and warnings in datasets
On Wed, Oct 13, 2010 at 11:23 AM, Janna Hastings <janna.h...@gmail.com> wrote: > <
10/18/10
Egon Willighagen
, …
Frank Gibson
30
9/15/10
how to annotate a molecular structure having a solvent role?
On Tue, Sep 14, 2010 at 5:42 PM, Michel Dumontier <michel.d...@gmail.com> wrote: >>
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how to annotate a molecular structure having a solvent role?
On Tue, Sep 14, 2010 at 5:42 PM, Michel Dumontier <michel.d...@gmail.com> wrote: >>
9/15/10
Egon Willighagen
, …
Janna Hastings
23
9/12/10
SMILES and SMARTS...
On Sun, Sep 12, 2010 at 12:02 PM, Janna Hastings <janna.h...@gmail.com> wrote: > I think
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SMILES and SMARTS...
On Sun, Sep 12, 2010 at 12:02 PM, Janna Hastings <janna.h...@gmail.com> wrote: > I think
9/12/10