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TITB
2010
120views Education» more  TITB 2010»
13 years 5 months ago
A distributed, collaborative intelligent agent system approach for proactive postmarketing drug safety surveillance
Discovering unknown adverse drug reactions (ADRs) in postmarketing surveillance as early as possible is of great importance. The current approach to postmarketing surveillance prim...
Yanqing Ji, Hao Ying, Margo S. Farber, John Yen, P...
NCA
2007
IEEE
13 years 10 months ago
Ensemble of hybrid neural network learning approaches for designing pharmaceutical drugs
Designing drugs is a current problem in the pharmaceutical research. By designing a drug we mean to choose some variables of drug formulation (inputs), for obtaining optimal charac...
Ajith Abraham, Crina Grosan, Stefan Tigan
NAR
2006
75views more  NAR 2006»
13 years 11 months ago
DrugBank: a comprehensive resource for in silico drug discovery and exploration
DrugBank is a unique bioinformatics/cheminformatics resource that combines detailed drug (i.e. chemical)data withcomprehensive drug target (i.e.protein) information. The database ...
David S. Wishart, Craig Knox, Anchi Guo, Savita Sh...
NAR
2006
120views more  NAR 2006»
13 years 11 months ago
SuperNatural: a searchable database of available natural compounds
Although tremendous effort has been put into synthetic libraries, most drugs on the market are still 10 natural compounds or derivatives thereof. There are encyclopaedias of natur...
Mathias Dunkel, Melanie Füllbeck, Stefanie Ne...
NAR
2006
108views more  NAR 2006»
13 years 11 months ago
GLIDA: GPCR-ligand database for chemical genomic drug discovery
G-protein coupled receptors (GPCRs) represent one of the most important families of drug targets in pharmaceutical development. GPCR-LIgand DAtabase (GLIDA) is a novel public GPCR...
Yasushi Okuno, Jiyoon Yang, Kei Taneishi, Hiroaki ...
JIB
2006
106views more  JIB 2006»
13 years 11 months ago
A structural keystone for drug design
3D-structures of proteins and potential ligands are the cornerstones of rational drug design. The first brick to build upon is selecting a protein target and finding out whether b...
Kristian Rother, Mathias Dunkel, Elke Michalsky, S...
BMCBI
2006
84views more  BMCBI 2006»
13 years 11 months ago
Representation of target-bound drugs by computed conformers: implications for conformational libraries
Background: The increasing number of known protein structures provides valuable information about pharmaceutical targets. Drug binding sites are identifiable and suitable lead com...
Stefan Günther, Christian Senger, Elke Michal...
BMCBI
2006
124views more  BMCBI 2006»
13 years 11 months ago
Network-based de-noising improves prediction from microarray data
Background: Prediction of human cell response to anti-cancer drugs (compounds) from microarray data is a challenging problem, due to the noise properties of microarrays as well as...
Tsuyoshi Kato, Yukio Murata, Koh Miura, Kiyoshi As...
CCE
2008
13 years 11 months ago
Optimal periodic control of a drug delivery system
Administration of certain drugs at a steady rate results in deterioration of drug effect, also known as drug tolerance. Periodic delivery is an attractive option for minimizing to...
Subbarao Varigonda, Tryphon T. Georgiou, Ronald A....
BMCBI
2008
172views more  BMCBI 2008»
13 years 11 months ago
Classification of drug molecules considering their IC50 values using mixed-integer linear programming based hyper-boxes method
Background: A priori analysis of the activity of drugs on the target protein by computational approaches can be useful in narrowing down drug candidates for further experimental t...
Pelin Armutlu, Muhittin Emre Ozdemir, Fadime Ü...