jerome's scaffold_hopping [9 articles] Export

Recent papers added to jerome's library classified by the tag scaffold_hopping. You can also see everyone's scaffold_hopping.

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	Heteroaromatic Rings of the Future [My Copy] Journal of Medicinal Chemistry, Vol. 52, No. 9. (14 May 2009), pp. 2952-2963. by William R. Pitt, David M. Parry, Benjamin G. Perry, Colin R. Groom posted to chemical_space chemotypes_definition raymond_john scaffold scaffold_hopping substructural_analysis by jerome on 2009-04-14 08:02:24 as along with 5 people and 1 group wozzza goncalojustino alfons ubcg08l higueruelo Cross Research Group
	The Scaffold Tree - Visualization of the Scaffold Universe by Hierarchical Scaffold Classification [My Copy] J. Chem. Inf. Model., Vol. 47, No. 1. (22 January 2007), pp. 47-58. by A. Schuffenhauer, P. Ertl, S. Roggo, S. Wetzel, M. A. Koch, H. Waldmann posted to schuffenhauer_ansgar scaffold_hopping mcs by jerome on 2007-01-23 23:58:34 as along with 5 people sschurer mdimmic dgruiz JALumley sithmein
	"Lead hopping". Validation of topomer similarity as a superior predictor of similar biological activities. [My Copy] J Med Chem, Vol. 47, No. 27. (30 December 2004), pp. 6777-6791. by R. D. Cramer, R. J. Jilek, S. Guessregen, S. J. Clark, B. Wendt, R. D. Clark posted to scaffold_hopping by jerome on 2005-06-01 13:10:57 as
	Algorithm for naming molecular equivalence classes represented by labeled pseudographs. [My Copy] J Chem Inf Comput Sci, Vol. 41, No. 1. (b 2001), pp. 181-185. by Y. Xu, M. Johnson posted to chemotypes_definition scaffold_hopping by jerome on 2005-05-31 17:13:59 as
	Using molecular equivalence numbers to visually explore structural features that distinguish chemical libraries. [My Copy] J Chem Inf Comput Sci, Vol. 42, No. 4. (g 2002), pp. 912-926. by Y. J. Xu, M. Johnson posted to chemotypes_definition scaffold_hopping by jerome on 2005-05-31 17:12:04 as
	The properties of known drugs. 1. Molecular frameworks. [My Copy] J Med Chem, Vol. 39, No. 15. (19 July 1996), pp. 2887-2893. by G. W. Bemis, M. A. Murcko posted to chemotypes_definition scaffold_hopping by jerome on 2005-05-31 13:44:41 as along with 1 person jerome_ucsf_slb
	Measuring CAMD technique performance: a virtual screening case study in the design of validation experiments. [My Copy] J Comput Aided Mol Des, Vol. 18, No. 7-9. (p 2004), pp. 529-536. by A. C. Good, M. A. Hermsmeier, S. A. Hindle posted to scaffold_hopping by jerome on 2005-05-25 16:47:31 as
	Descriptors you can count on? Normalized and filtered pharmacophore descriptors for virtual screening. [My Copy] J Comput Aided Mol Des, Vol. 18, No. 7-9. (p 2004), pp. 523-527. by A. C. Good, S. J. Cho, J. S. Mason posted to descriptor scaffold_hopping by jerome on 2005-05-25 16:46:57 as along with 1 person and 2 groups sangeetha Bioinformatics insilicodrug
	A 3D similarity method for scaffold hopping from known drugs or natural ligands to new chemotypes. [My Copy] J Med Chem, Vol. 47, No. 25. (2 December 2004), pp. 6144-6159. by J. L. Jenkins, M. Glick, J. W. Davies posted to descriptor scaffold_hopping by jerome on 2005-05-25 16:36:05 as along with 2 people and 2 groups ucbcjbm sangeetha Bioinformatics insilicodrug

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similarity_general	12
bayesian_learning	9
scaffold_hopping	9
prediction	8
review	8
willett_peter	8
personal	7
statistics	7
chemical_space	6
modeling	6
polypharmacology	6
chemotypes_definition	5
data_fusion	5
ligand_based_virtual_screening	5
multitargets	5
toxicology	5
biology	4
hts_analysis	4
ontology	4
protein_ligand_interaction	4
raymond_john	4
substructural_analysis	4
bender_andreas	3
descriptor	3
docking	3
experimental	3
fingerprint	3
flurorine	3
fragment	3
mcs	3
model	3
networks	3
quantitative	3
scaffold	3
schuffenhauer_ansgar	3
structural_biology	3
compound_selection	2
deconvolution	2
geometry	2
gpcr	2
history	2
hts	2
information_retrieval	2
nbt	2
reuse	2
roche	2
target_fishing	2
accessibility	1
activity	1
admet	1
affinity	1
auto_definition_chemotypes	1
baldi	1
bayesian_alternates	1
binding_site	1
chemistry	1
computational_chemistry	1
drug_discovery	1
flexibility	1
homology	1
kearsley_simon	1
library_design	1
nomenclature	1
nrdd	1
pdb	1
pharmacophores	1
sar	1
sheridan_robert	1
structure_based_virtual_screening	1
svm	1
synthetic	1

jerome's scaffold_hopping [9 articles] Export

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