nicklynch's cheminformatics [10 articles] Export

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	Knowledge-Based Approach to de Novo Design Using Reaction Vectors [My Copy] Journal of Chemical Information and Modeling, Vol. 49, No. 5. (22 May 2009), pp. 1163-1184. by Hina Patel, Michael J. Bodkin, Beining Chen, Valerie J. Gillet posted to workflow knowledge drug design cheminformatics by nicklynch on 2009-10-26 13:22:32 as along with 1 person alfons
	FOG: Fragment Optimized Growth Algorithm for the de Novo Generation of Molecules Occupying Druglike Chemical Space [My Copy] Journal of Chemical Information and Modeling, Vol. 49, No. 7. (27 July 2009), pp. 1630-1642. by Peter S. Kutchukian, David Lou, Eugene I. Shakhnovich posted to cheminformatics by nicklynch on 2009-08-05 11:48:49 as along with 2 people nickolay alfons
	5-Aminopyrimidin-2-ylnitriles as Cathepsin K inhibitors [My Copy] Bioorganic & Medicinal Chemistry Letters (06 February 2009) by Andrew D. Morley, Peter W. Kenny, Brenda Burton, et al.Robert A. Heald, Philip A. Macfaul, Julia Mullett, Ken Page, Soraya S. Porres, Lyn R. Ribeiro, Phil Smith posted to cheminformatics virtual by nicklynch on 2009-02-23 14:02:01 as
	Towards in-house searching of Markush structures from patents☆ [My Copy] World Patent Information (25 November 2008) by J. Barnard, P. Matthewwright posted to cheminformatics markush by nicklynch on 2008-12-12 13:34:16 as along with 1 person N-te_Jr
	Dealing with a data dilemma [My Copy] Nat Rev Drug Discov, Vol. 7, No. 8. (2008), pp. 632-633. posted to cheminformatics data hts screening by nicklynch on 2008-11-10 21:32:09 as
	Role of the Internet in chemoinformatics: Recent developments [My Copy] Current Opinion in Drug Discovery by Casher posted to cheminformatics web by nicklynch on 2008-11-10 21:30:24 as
	Introduction to Cheminformatics : Current Protocols in Bioinformatics : Wiley InterScience [My Copy] posted to bioinformatics cheminformatics workflow by nicklynch on 2008-11-10 21:25:30 as
	Pybel: a Python wrapper for the OpenBabel cheminformatics toolkit. [My Copy] Chemistry Central journal, Vol. 2 (2008) by N. M. O'Boyle, C. Morley, G. R. Hutchison posted to cheminformatics opensource by nicklynch on 2008-11-09 15:57:46 as along with 3 people Scis0000002 ghutchis massivemayhem
	Creating chemo- & bioinformatics workflows, further developments within the CDK-Taverna Project [My Copy] Chemistry Central Journal posted to cheminformatics informatics opensource workflow by nicklynch on 2008-11-09 15:08:05 as
	Bioinformatics and cheminformatics: Where do the twain meet? [My Copy] Current opinion in drug discovery & development, Vol. 11, No. 3. (May 2008), pp. 311-319. by N. Sukumar, M. Krein, C. M. Breneman posted to bioinformatics cheminformatics informatics by nicklynch on 2008-11-09 14:53:15 as along with 1 person dullhunk

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informatics	31
drug	31
discovery	29
integration	16
collaboration	14
semantic	14
chemistry	14
opensource	13
web	12
business	11
workflow	11
data	10
cheminformatics	10
pharmaceutical	9
bioinformatics	8
systems	7
biology	7
ontology	7
innovation	6
biomedical	6
lean	5
industry	5
management	5
translational	5
prediction	4
knowledge	4
grid	4
virtual	3
sar	3
lead	3
qsar	3
screening	3
framework	2
clustering	2
webservice	2
computing	2
clinical	2
hts	2
genome	2
mining	2
process	2
visualisation	2
literature	1
query	1
compound	1
gene	1
design	1
compchem	1
properties	1
combinations	1
pharma	1
software	1
proteomics	1
open	1
intelligence	1
services	1
sequence	1
lsid	1
value	1
architecture	1
standard	1
source	1
markush	1
cell	1
inte	1
artifical	1
compbio	1
chain	1
matrix	1
citation	1
decision	1
public	1
generation	1
pharmacogenomics	1
selection	1
saas	1
taxonomy	1
information	1
physiochemical	1
target	1
agile	1
adme	1
pathways	1
safety	1

nicklynch's cheminformatics [10 articles] Export

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