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Group: insilicodrug - library [179 articles]

小组成员近期录入的文献 insilicodrug 兴趣小组
  • MULTIPROSPECTOR: an algorithm for the prediction of protein-protein interactions by multimeric threading.
    Proteins, Vol. 49, No. 3. (15 November 2002), pp. 350-364.
    by L Lu, H Lu, J Skolnick
    posted to no-tag by sangeetha to the group insilicodrug on 2007-08-29 05:40:39 as ** along with 6 people and 4 groups ana bicko chad_davis marcius ruvido kgutwin structural_bioinformatics Bioinformatics BioinfoCIPF SGU-CIPF
  • Protein Kinases as Targets for Antiparasitic Chemotherapy Drugs
    Current Drug Targets, Vol. 8, No. 3. (March 2007), pp. 389-398.
    by Canduri, Fernanda, Cardoso Perez, Patricia, Caceres, A Rafael, De Azevedo, F Walter
    posted to to related malaria by sangeetha to the group insilicodrug on 2007-07-30 05:35:20 as ** along with 1 group Bioinformatics
  • Target-Oriented and Diversity-Oriented Organic Synthesis in Drug Discovery
    Science, Vol. 287, No. 5460. (17 March 2000), pp. 1964-1969.
    by Stuart L Schreiber
    posted to target-oriented by sangeetha to the group insilicodrug on 2007-07-24 08:03:13 as ** along with 1 person and 1 group jerome_ucsf_slb Bioinformatics
  • Assessment of blind predictions of protein-protein interactions: current status of docking methods.
    Proteins, Vol. 52, No. 1. (1 July 2003), pp. 51-67.
    by R Mendez, R Leplae, L De Maria, SJ Wodak
    posted to protein-protein interactions by sangeetha to the group insilicodrug on 2007-07-11 10:32:11 as *** along with 4 people and 1 group bicko chad_davis ima cjeans Bioinformatics
  • Chemical compound navigator: A web-based chem-BLAST, chemical taxonomy-based search engine for browsing compounds
    posted to virtual_screening by sangeetha to the group insilicodrug on 2007-06-14 10:47:56 as ** along with 1 group Bioinformatics
  • The dose makes the medicine
    posted to the medicine makes dose by sangeetha to the group insilicodrug on 2007-06-14 10:46:44 as ** along with 1 group Bioinformatics
  • Virtual screening: Are we there yet?
    posted to virtual_screening by sangeetha to the group insilicodrug on 2007-06-14 10:45:29 as ** along with 1 person and 4 groups joergkurtwegner Bioinformatics Molecular-Modelling Drug-Design Cheminformatics
  • Collection and preparation of molecular databases for virtual screening
    posted to virtual screening by sangeetha to the group insilicodrug on 2007-06-14 10:43:53 as ** along with 1 group Bioinformatics
  • Computational identification and analysis of G protein-coupled receptor targets
    posted to identificatio computational by sangeetha to the group insilicodrug on 2007-06-14 10:42:11 as ** along with 1 group Bioinformatics
  • Drug discovery: a historical perspective.
    Science, Vol. 287, No. 5460. (17 March 2000), pp. 1960-1964.
    by J Drews
    posted to drug discovery by sangeetha to the group insilicodrug on 2007-06-14 09:42:14 as ** along with 11 people and 4 groups Yanno BragilMassoud nachtalp kuhn Borelli joergkurtwegner jdiggans ramensky LamBras srp33 yaredo Bioinformatics Molecular-Modelling Drug-Design Cheminformatics
  • DrugBank: a comprehensive resource for in silico drug discovery and exploration.
    Nucleic Acids Res, Vol. 34, No. Database issue. (1 January 2006)
    by DS Wishart, C Knox, AC Guo, S Shrivastava, M Hassanali, P Stothard, Z Chang, J Woolsey
    posted to virtual screening by sangeetha to the group insilicodrug on 2007-06-11 10:31:50 as ** along with 7 people and 1 group dansullivanblk kuhn maryee madhadron jdiggans massivemayhem elvinado Bioinformatics
  • New approach to molecular docking and its application to virtual screening of chemical databases
    posted to virtual screening by sangeetha to the group insilicodrug on 2007-06-08 07:57:52 as ** along with 1 group Bioinformatics
  • Alanine-scanning Mutagenesis of Aspergillus γ-Tubulin Yields Diverse and Novel PhenotypesV in Box
    posted to alanine-scanning by sangeetha to the group insilicodrug on 2007-06-01 07:50:50 as ** along with 1 group Bioinformatics
  • Unraveling the Importance of Protein-Protein Interaction: Application of a Computational Alanine-Scanning Mutagenesis to the Study of the IgG1 Streptococcal Protein G (C2 Fragment) Complex
    posted to scanning alanine by sangeetha to the group insilicodrug on 2007-06-01 07:49:51 as ** along with 1 group Bioinformatics
  • Computational alanine scanning of protein-protein interfaces.
    Sci STKE, Vol. 2004, No. 219. (10 February 2004)
    by T Kortemme, DE Kim, D Baker
    posted to no-tag by sangeetha to the group insilicodrug on 2007-05-31 11:53:30 as ** along with 4 people and 5 groups barry blackbart joergkurtwegner skoddet structural_bioinformatics Bioinformatics Molecular-Modelling Drug-Design Cheminformatics
  • Surflex-Dock 2.1: Robust performance from ligand energetic modeling, ring flexibility, and knowledge-based search.
    J Comput Aided Mol Des (27 March 2007)
    by Ajay N Jain
    posted to modelling by sangeetha to the group insilicodrug on 2007-05-11 10:44:40 as ** along with 1 person and 1 group BragilMassoud Bioinformatics
  • TrixX: structure-based molecule indexing for large-scale virtual screening in sublinear time.
    J Comput Aided Mol Des (9 February 2007)
    by Ingo Schellhammer, Matthias Rarey
    posted to no-tag by sangeetha to the group insilicodrug on 2007-05-08 12:05:31 as ** along with 2 people and 1 group BragilMassoud peprovy Bioinformatics
  • When is homology not homology?
    Curr Opin Genet Dev, Vol. 8, No. 6. (December 1998), pp. 675-680.
    by GA Wray, E Abouheif
    posted to homology by sangeetha to the group insilicodrug on 2007-03-20 09:36:28 as ** along with 2 people and 1 group anatiferous neetiitr Bioinformatics
  • Successful Virtual Screening for a Submicromolar Antagonist of the Neurokinin-1 Receptor Based on a Ligand-Supported Homology Model
    J. Med. Chem., Vol. 47, No. 22. (21 October 2004), pp. 5381-5392.
    by A Evers, G Klebe
    posted to virtual_screening by sangeetha to the group insilicodrug on 2007-03-20 09:35:58 as ** along with 2 people and 1 group daevans Guff32 Bioinformatics
  • JSTOR: Proceedings of the National Academy of Sciences of the United States of America: Vol. 93, No. 12 (Jun. 11, 1996), pp. 5808-5813
    posted to no-tag by sangeetha to the group insilicodrug on 2007-02-23 11:14:38 as *** along with 1 group Bioinformatics
  • Serine proteases: An ab initio molecular dynamics study
    Proteins: Structure, Function, and Genetics, Vol. 37, No. 4. (1999), pp. 611-618.
    by L De Santis, P Carloni
    posted to md simulation by sangeetha to the group insilicodrug on 2006-12-29 07:07:46 as **** along with 1 group Bioinformatics
  • A molecular mechanics/grid method for evaluation of ligand-receptor interactions
    Journal of Computational Chemistry, Vol. 16, No. 4. (1995), pp. 454-464.
    by Brock A Luty, Zelda R Wasserman, Pieter FW Stouten, Nicholas C Hodge, Martin Zacharias, Andrew J Mccammon
    posted to md simulation by sangeetha to the group insilicodrug on 2006-12-29 07:05:59 as **** along with 1 person and 1 group papatonyhill Bioinformatics
  • Regulation of proteasome structure and function
    (1997)
    by AJ Rivett
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 08:52:56 as ** along with 1 group Bioinformatics
  • Proteasome-Related HslU and HslV Genes Typical of Eubacteria Are Widespread in Eukaryotes.
    J Mol Evol, Vol. 63, No. 4. (October 2006), pp. 504-512.
    by MX Ruiz-González, I Marín
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:52:21 as ** along with 1 group Bioinformatics
  • The ATP-dependent CodWX (HslVU) protease in Bacillus subtilis is an N-terminal serine protease
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:48:53 as ** along with 1 group Bioinformatics
  • Inactivation of the 20S proteasome in Mycobacterium smegmatis
    Molecular Microbiology, Vol. 25, No. 02. (1997), pp. 375-383.
    by Nancianne Knipfer, Thomas E Shrader
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:44:38 as ** along with 1 group Bioinformatics
  • A new structural class of proteasome inhibitors identified by microbial screening using yeast-based assay.
    Biochem Pharmacol, Vol. 67, No. 2. (15 January 2004), pp. 227-234.
    by A Asai, T Tsujita, SV Sharma, Y Yamashita, S Akinaga, M Funakoshi, H Kobayashi, T Mizukami
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:12:41 as ** along with 1 group Bioinformatics
  • The core structure of TMC-95A is a promising lead for reversible proteasome inhibition.
    Angew Chem Int Ed Engl, Vol. 41, No. 5. (1 March 2002), pp. 780-783.
    by M Kaiser, M Groll, C Renner, R Huber, L Moroder
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:11:47 as ** along with 1 group Bioinformatics
  • TMC-95-based inhibitor design provides evidence for the catalytic versatility of the proteasome.
    Chem Biol, Vol. 13, No. 6. (June 2006), pp. 607-614.
    by M Groll, M Götz, M Kaiser, E Weyher, L Moroder
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:10:51 as ** along with 1 group Bioinformatics
  • A hitchhiker's guide to the proteasome.
    Sci STKE, Vol. 2001, No. 97. (28 August 2001)
    by AG von Arnim
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:03:36 as ** along with 1 person and 1 group helenc Bioinformatics
  • 20S proteasomes and protein degradation "by default".
    Bioessays, Vol. 28, No. 8. (August 2006), pp. 844-849.
    by G Asher, N Reuven, Y Shaul
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:02:06 as ** along with 1 person and 1 group chad_davis Bioinformatics
  • Bacterial protease inhibitors
    Medicinal Research Reviews, Vol. 22, No. 4. (2002), pp. 329-372.
    by Claudiu T Supuran, Andrea Scozzafava, Brian W Clare
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:02:02 as ** along with 1 group Bioinformatics
  • Shared components of protein complexes - versatile building blocks or biochemical artefacts?
    BioEssays, Vol. 26, No. 12. (2004), pp. 1333-1343.
    by Roland Krause, Christian von Mering, Peer Bork, Thomas Dandekar
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 06:01:13 as ** along with 1 group Bioinformatics
  • Drug discovery in the ubiquitin–proteasome system
    Nature Reviews Drug Discovery, Vol. 5, No. 7., pp. 596-613.
    by Grzegorz Nalepa, Mark Rolfe, Wade J Harper
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 05:49:29 as ** along with 3 people and 3 groups jyuh dchughes Garth_9145 Bioinformatics G4ID Genetics-of-Gambling
  • Mechanistic studies on the inactivation of the proteasome by lactacystin in cultured cells.
    J Biol Chem, Vol. 272, No. 1. (3 January 1997), pp. 182-188.
    by LR Dick, AA Cruikshank, AT Destree, L Grenier, TA McCormack, FD Melandri, SL Nunes, VJ Palombella, LA Parent, L Plamondon, RL Stein
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 05:49:17 as ** along with 1 group Bioinformatics
  • Proteasome inhibitors: valuable new tools for cell biologists
    Trends in Cell Biology, Vol. 8, No. 10. (01 October 1998), pp. 397-403.
    by Do H Lee, Alfred L Goldberg
    posted to proteasome by sangeetha to the group insilicodrug on 2006-11-24 05:48:53 as ** along with 1 group Bioinformatics
  • Integration of virtual and high-throughput screening.
    Nat Rev Drug Discov, Vol. 1, No. 11. (November 2002), pp. 882-894.
    by J Bajorath
    posted to screening virtual by sangeetha to the group insilicodrug on 2006-11-23 08:22:14 as ** along with 4 people and 1 group jerome BragilMassoud grimbart sithmein Bioinformatics
  • Binding MOAD (Mother Of All Databases).
    Proteins (21 June 2005)
    by Liegi Hu, Mark L L Benson, Richard D D Smith, Michael G G Lerner, Heather A A Carlson
    posted to databases by sangeetha to the group insilicodrug on 2006-05-31 10:25:59 as ** along with 6 people and 9 groups BragilMassoud shantanu caporaso blackbart papatonyhill higueruelo structural_bioinformatics MathBio Biostatistics Bioinformatics microRNA Computational_Systems_Biology EvolutionaryComputation Computational-Neurobiology biomedical-nlp
  • High-throughput and in silico techniques in drug metabolism and pharmacokinetics.
    Curr Opin Drug Discov Devel, Vol. 5, No. 1. (January 2002), pp. 33-43.
    by H van de Waterbeemd
    posted to and high-throughput in silico techniques by sangeetha to the group insilicodrug on 2006-05-31 10:25:19 as ** along with 1 person and 1 group paolo Bioinformatics
  • High-throughput screening: new technology for the 21st century.
    Curr Opin Chem Biol, Vol. 4, No. 4. (August 2000), pp. 445-451.
    by RP Hertzberg, AJ Pope
    posted to high-throughput screening by sangeetha to the group insilicodrug on 2006-05-31 10:25:08 as ** along with 1 person and 1 group paolo Bioinformatics
  • Comparison of support vector machine and artificial neural network systems for drug/nondrug classification.
    J Chem Inf Comput Sci, Vol. 43, No. 6. (c 2003), pp. 1882-1889.
    by E Byvatov, U Fechner, J Sadowski, G Schneider
    posted to svm by sangeetha to the group insilicodrug on 2006-05-31 10:24:21 as ** along with 2 people and 1 group craigtalbert paolo Bioinformatics
  • Molecular similarity: a key technique in molecular informatics.
    Org Biomol Chem, Vol. 2, No. 22. (21 November 2004), pp. 3204-3218.
    by A Bender, RC Glen
    posted to cheminformatics by sangeetha to the group insilicodrug on 2006-05-31 10:23:41 as ** along with 4 people and 1 group jerome paolo noby sithmein Bioinformatics
  • Structure validation by Calpha geometry: phi,psi and Cbeta deviation
    Proteins, Vol. 50, No. 3. (15 February 2003), pp. 437-450.
    by Simon C Lovell, Ian W Davis, Arendall, Paul I de Bakker, Michael J Word, Michael G Prisant, Jane S Richardson, David C Richardson
    posted to protein structure by sangeetha to the group insilicodrug on 2006-05-31 10:19:50 as ** along with 2 people and 5 groups barry joergkurtwegner structural_bioinformatics Bioinformatics Molecular-Modelling Drug-Design Cheminformatics
  • Mary Ann Liebert, Inc. - Journal of Computational Biology - 6(3-4):447
    posted to cheminformatics by sangeetha to the group insilicodrug on 2006-05-04 08:44:21 as ** along with 1 group Bioinformatics
  • Scalable molecular dynamics with NAMD.
    J Comput Chem, Vol. 26, No. 16. (December 2005), pp. 1781-1802.
    by JC Phillips, R Braun, W Wang, J Gumbart, E Tajkhorshid, E Villa, C Chipot, RD Skeel, L Kalé, K Schulten
    posted to dynamics molecular by sangeetha to the group insilicodrug on 2006-05-01 13:01:07 as ** along with 8 people and 4 groups dimka jwm ttjoseph yoel_rf bilab wilsoros sobolevnrm ibuch Radiation_Damage Stressosome Bioinformatics baker-group
  • Parallel Protein Puzzle: A New Suite of Protein Docking Tools
    by Hans P Lenhof
    posted to docking by sangeetha to the group insilicodrug on 2006-05-01 12:14:01 as ** along with 1 person and 1 group ima Bioinformatics
  • PRODRG, a program for generating molecular topologies and unique molecular descriptors from coordinates of small molecules.
    J Comput Aided Mol Des, Vol. 10, No. 3. (June 1996), pp. 255-262.
    by DM van Aalten, R Bywater, JB Findlay, M Hendlich, RW Hooft, G Vriend
    posted to descriptors by sangeetha to the group insilicodrug on 2006-05-01 11:32:16 as ** along with 1 person and 1 group dgruiz Bioinformatics
  • Similarity searching in files of three-dimensional chemical structures: analysis of the BIOSTER database using two-dimensional fingerprints and molecular field descriptors
    J Chem Inf Comput Sci, Vol. 40, No. 2. (March 2000), pp. 295-307.
    by A Schuffenhauer, VJ Gillet, P Willett
    posted to descriptors by sangeetha to the group insilicodrug on 2006-05-01 11:31:53 as *** along with 1 person and 1 group jerome Bioinformatics
  • Physicochemical Descriptors in Property-Based Drug Design
    Mini Reviews in Medicinal Chemistry, Vol. 4, No. 10., 1041.
    by Oleg A Raevsky
    posted to descriptors by sangeetha to the group insilicodrug on 2006-05-01 11:30:21 as ** along with 1 group Bioinformatics
  • Flexible protein-protein docking
    Current Opinion in Structural Biology, Vol. 16, No. 2. (April 2006), pp. 194-200.
    by Alexandre MJJ Bonvin
    posted to docking by sangeetha to the group insilicodrug on 2006-05-01 10:57:26 as ** along with 7 people and 2 groups dgruiz aqeel bicko yongzhao ima gloria higueruelo Bioinformatics TSRI_MGL
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