-
1
-
-
84883599292
-
-
Chemical Structure Lookup Service (CSLS) . Accessed 27 Oct 2010
-
Chemical Structure Lookup Service (CSLS). http://cactus.nci.nih.gov/ lookup . Accessed 27 Oct 2010
-
-
-
-
2
-
-
75849153303
-
The universal protein resource (UniProt) in 2010
-
The UniProt Consortium.
-
The UniProt Consortium (2010) The universal protein resource (UniProt) in 2010. Nucleic Acids Res 38:D142-D148
-
(2010)
Nucleic Acids Res
, vol.38
-
-
-
3
-
-
74049098222
-
Quantitative assessment of the expanding complementarity between public and commercial databases of bioactive compounds
-
doi: 10.1186/1758-2946-1-10
-
Southan C, Varkonyi P, Muresan S (2009) Quantitative assessment of the expanding complementarity between public and commercial databases of bioactive compounds. J Cheminfo. http://www.jcheminf.com/content/1/1/10 . doi: 10.1186/1758-2946-1-10
-
(2009)
J Cheminfo
-
-
Southan, C.1
Varkonyi, P.2
Muresan, S.3
-
4
-
-
84883601044
-
-
Accessed 19 Sept 2010
-
ChEMBL. http://www.ebi.ac.uk/chembl . Accessed 19 Sept 2010
-
-
-
-
5
-
-
38549151817
-
DrugBank: A knowledgebase for drugs, drug actions and drug targets
-
DOI 10.1093/nar/gkm958
-
Wishart DS, Knox C, Guo AC et al (2008) DrugBank: a knowledgebase for drugs, drug actions and drug targets. Nucleic Acids Res 36:D901-D906 (Pubitemid 351149842)
-
(2008)
Nucleic Acids Research
, vol.36
, Issue.SUPPL. 1
-
-
Wishart, D.S.1
Knox, C.2
Guo, A.C.3
Cheng, D.4
Shrivastava, S.5
Tzur, D.6
Gautam, B.7
Hassanali, M.8
-
7
-
-
75549090848
-
Update of TTD: Therapeutic target database
-
Zhu F, Han B, Kumar P et al (2010) Update of TTD: therapeutic target database. Nucleic Acids Res 38:D787-D791
-
(2010)
Nucleic Acids Res
, vol.38
-
-
Zhu, F.1
Han, B.2
Kumar, P.3
-
8
-
-
84883597710
-
-
The Protein Identi fi er Cross-Reference Service. Accessed 27 Oct 2010
-
The Protein Identi fi er Cross-Reference Service. http://www.ebi.ac.uk/ Tools/picr/init.do . Accessed 27 Oct 2010
-
-
-
-
9
-
-
84883597920
-
-
The IUPAC International Chemical Identi fi er (Version 1.03) . Accessed 27 Oct 2010.
-
The IUPAC International Chemical Identi fi er (Version 1.03). http://www.iupac.org/inchi/release103.html . Accessed 27 Oct 2010.
-
-
-
-
10
-
-
84883600638
-
-
NCI/CADD Chemical Identi fi er Resolver. Accessed 27 Oct 2010
-
NCI/CADD Chemical Identi fi er Resolver. http://cactus.nci.nih.gov/ chemical/structure . Accessed 27 Oct 2010.
-
-
-
-
13
-
-
0023965741
-
Smiles, a chemical language and information system. I. Introduction to methodology and encoding rules
-
Weininger D (1988) SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules. J Chem Inf Comput Sci 28:31-36. (Pubitemid 18574254)
-
(1988)
Journal of Chemical Information and Computer Sciences
, vol.28
, Issue.1
, pp. 31-36
-
-
Weininger, D.1
-
14
-
-
84883597995
-
-
Daylight Chemical Information Systems Inc. Accessed 27 Oct 2010.
-
Daylight Chemical Information Systems Inc. http://www.daylight.com . Accessed 27 Oct 2010.
-
-
-
-
15
-
-
0001708959
-
Description of several chemical structure fi le formats used by computer programs developed at Molecular Design Limited
-
Dalby A, Nourse JG, Hounshell WD et al (1992) Description of several chemical structure fi le formats used by computer programs developed at Molecular Design Limited. J Chem Inf Comput Sci 32:244-255.
-
(1992)
J Chem Inf Comput Sci
, vol.32
, pp. 244-255
-
-
Dalby, A.1
Nourse, J.G.2
Hounshell, W.D.3
-
16
-
-
84883598328
-
-
CT fi le Formats . Accessed 27 Oct 2010.
-
CT fi le Formats. http://www.symyx.com/downloads/public/ctfile/ct fi le.jsp . Accessed 27 Oct 2010.
-
-
-
-
18
-
-
84986533812
-
Hash codes for the identi fi cation and classi fi cation of molecular structure elements
-
Ihlenfeldt WD, Gasteiger J (1994) Hash codes for the identi fi cation and classi fi cation of molecular structure elements. J Comput Chem 15:793-813.
-
(1994)
J Comput Chem
, vol.15
, pp. 793-813
-
-
Ihlenfeldt, W.D.1
Gasteiger, J.2
-
19
-
-
84883597932
-
-
InChI TRUST-History of InChI. Accessed 10 Sept 2010
-
InChI TRUST-History of InChI. http://www.inchi-trust.org/index.php?q= node/2 . Accessed 10 Sept 2010.
-
-
-
-
20
-
-
84883597885
-
-
Accessed 10 Sept 2010
-
CAS Registry Numbers. http://www.cas.org/index.html . Accessed 10 Sept 2010.
-
-
-
-
21
-
-
84883597537
-
-
Accessed 10 Oct 2010
-
ChemSpider. http://www.chemspider.com . Accessed 10 Oct 2010.
-
-
-
-
22
-
-
78649633211
-
PubChem as a public resource for drug discovery
-
Li Q, Cheng T, Wang Y et al (2010) PubChem as a public resource for drug discovery. Drug Discov Today 15:1052-1057.
-
(2010)
Drug Discov Today
, vol.15
, pp. 1052-1057
-
-
Li, Q.1
Cheng, T.2
Wang, Y.3
-
24
-
-
0028336046
-
Computation and management of chemical properties in CACTVS: An extensible networked approach toward modularity and compatibility
-
Ihlenfeldt WD, Takahashi Y, Abe H et al (1994) Computation and management of chemical properties in CACTVS: an extensible networked approach toward modularity and compatibility. J Chem Inf Comput Sci 34:109-116.
-
(1994)
J Chem Inf Comput Sci
, vol.34
, pp. 109-116
-
-
Ihlenfeldt, W.D.1
Takahashi, Y.2
Abe, H.3
-
25
-
-
84883598581
-
-
Accessed 10 Oct 2010
-
Xemistry GmbH. http://xemistry.com . Accessed 10 Oct 2010.
-
-
-
-
26
-
-
84883600410
-
-
ChemNavigator-iResearch Library . Accessed 10 Oct 2010.
-
ChemNavigator-iResearch Library. http://www.chemnavigator.com/cnc/ products/iRL. asp . Accessed 10 Oct 2010.
-
-
-
-
27
-
-
84883598070
-
-
PubChem Substance Set. Accessed 10 Oct 2010
-
PubChem Substance Set. ftp://ftp.ncbi.nlm.nih.gov/pubchem/Substance/ CURRENTFull . Accessed 10 Oct 2010.
-
-
-
-
28
-
-
13844312649
-
ZINC - A free database of commercially available compounds for virtual screening
-
DOI 10.1021/ci049714+
-
Irwin JJ, Shoichet BK (2005) ZINC-a free database of commercially available compounds for virtual screening. J Chem Inf Model 45:177-182. (Pubitemid 40736970)
-
(2005)
Journal of Chemical Information and Modeling
, vol.45
, Issue.1
, pp. 177-182
-
-
Irwin, J.J.1
Shoichet, B.K.2
-
29
-
-
84883597150
-
-
Accessed 8 Sept 2010
-
eMolecules. http://www.emolecules.com . Accessed 8 Sept 2010.
-
-
-
-
31
-
-
33947380146
-
Mass spectrometric characterization of the affinity-purified human 26S proteasome complex
-
DOI 10.1021/bi061994u
-
Wang X, Chen C-F, Baker PR et al (2007) Mass spectrometric characterization of the af fi nity-puri fi ed human 26S proteasome complex. Biochemistry 46:3553-3565 (Pubitemid 46449172)
-
(2007)
Biochemistry
, vol.46
, Issue.11
, pp. 3553-3565
-
-
Wang, X.1
Chen, C.-F.2
Baker, P.R.3
Chen, P.-L.4
Kaiser, P.5
Huang, L.6
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