These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

141 related articles for article (PubMed ID: 21882847)

  • 21. Quantitative Proteome-Property Relationships (QPPRs). Part 1: finding biomarkers of organic drugs with mean Markov connectivity indices of spiral networks of blood mass spectra.
    Cruz-Monteagudo M; Munteanu CR; Borges F; Cordeiro MN; Uriarte E; González-Díaz H
    Bioorg Med Chem; 2008 Nov; 16(22):9684-93. PubMed ID: 18951807
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Exploring SAR continuity in the vicinity of activity cliffs.
    Namasivayam V; Iyer P; Bajorath J
    Chem Biol Drug Des; 2012 Jan; 79(1):22-9. PubMed ID: 21985661
    [TBL] [Abstract][Full Text] [Related]  

  • 23. What are the limits of applicability for graph theoretic descriptors in QSPR/QSAR? Modeling dipole moments of aromatic compounds with TOPS-MODE descriptors.
    Estrada E; González H
    J Chem Inf Comput Sci; 2003; 43(1):75-84. PubMed ID: 12546541
    [TBL] [Abstract][Full Text] [Related]  

  • 24. A structure-information approach to the prediction of biological activities and properties.
    Hall LH
    Chem Biodivers; 2004 Jan; 1(1):183-201. PubMed ID: 17191786
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Similarity metrics for ligands reflecting the similarity of the target proteins.
    Schuffenhauer A; Floersheim P; Acklin P; Jacoby E
    J Chem Inf Comput Sci; 2003; 43(2):391-405. PubMed ID: 12653501
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Chemodiversity and molecular plasticity: recognition processes as explored by property spaces.
    Vistoli G; Pedretti A; Testa B
    Future Med Chem; 2011 Jun; 3(8):995-1010. PubMed ID: 21707401
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Mold(2), molecular descriptors from 2D structures for chemoinformatics and toxicoinformatics.
    Hong H; Xie Q; Ge W; Qian F; Fang H; Shi L; Su Z; Perkins R; Tong W
    J Chem Inf Model; 2008 Jul; 48(7):1337-44. PubMed ID: 18564836
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Design of multitarget activity landscapes that capture hierarchical activity cliff distributions.
    Dimova D; Wawer M; Wassermann AM; Bajorath J
    J Chem Inf Model; 2011 Feb; 51(2):258-66. PubMed ID: 21275393
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Bioactivity landscape modeling: chemoinformatic characterization of structure-activity relationships of compounds tested across multiple targets.
    Waddell J; Medina-Franco JL
    Bioorg Med Chem; 2012 Sep; 20(18):5443-52. PubMed ID: 22178187
    [TBL] [Abstract][Full Text] [Related]  

  • 30. From molecular to biological structure and back.
    Bonchev D; Buck GA
    J Chem Inf Model; 2007; 47(3):909-17. PubMed ID: 17407281
    [TBL] [Abstract][Full Text] [Related]  

  • 31. In silico binary classification QSAR models based on 4D-fingerprints and MOE descriptors for prediction of hERG blockage.
    Su BH; Shen MY; Esposito EX; Hopfinger AJ; Tseng YJ
    J Chem Inf Model; 2010 Jul; 50(7):1304-18. PubMed ID: 20565102
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Anticancer activity of selected phenolic compounds: QSAR studies using ridge regression and neural networks.
    Nandi S; Vracko M; Bagchi MC
    Chem Biol Drug Des; 2007 Nov; 70(5):424-36. PubMed ID: 17949360
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Crystal fingerprint space--a novel paradigm for studying crystal-structure sets.
    Valle M; Oganov AR
    Acta Crystallogr A; 2010 Sep; 66(Pt 5):507-17. PubMed ID: 20720316
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Design of a three-dimensional multitarget activity landscape.
    de la Vega de León A; Bajorath J
    J Chem Inf Model; 2012 Nov; 52(11):2876-83. PubMed ID: 23113585
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Neighborhood behavior of in silico structural spaces with respect to in vitro activity spaces-a novel understanding of the molecular similarity principle in the context of multiple receptor binding profiles.
    Horvath D; Jeandenans C
    J Chem Inf Comput Sci; 2003; 43(2):680-90. PubMed ID: 12653538
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Computational analysis of activity and selectivity cliffs.
    Peltason L; Bajorath J
    Methods Mol Biol; 2011; 672():119-32. PubMed ID: 20838966
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Critical assessment of QSAR models of environmental toxicity against Tetrahymena pyriformis: focusing on applicability domain and overfitting by variable selection.
    Tetko IV; Sushko I; Pandey AK; Zhu H; Tropsha A; Papa E; Oberg T; Todeschini R; Fourches D; Varnek A
    J Chem Inf Model; 2008 Sep; 48(9):1733-46. PubMed ID: 18729318
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Unified QSAR approach to antimicrobials. Part 3: first multi-tasking QSAR model for input-coded prediction, structural back-projection, and complex networks clustering of antiprotozoal compounds.
    Prado-Prado FJ; González-Díaz H; de la Vega OM; Ubeira FM; Chou KC
    Bioorg Med Chem; 2008 Jun; 16(11):5871-80. PubMed ID: 18485714
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Impact of benchmark data set topology on the validation of virtual screening methods: exploration and quantification by spatial statistics.
    Rohrer SG; Baumann K
    J Chem Inf Model; 2008 Apr; 48(4):704-18. PubMed ID: 18380447
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Visual and haptic perceptual spaces show high similarity in humans.
    Gaissert N; Wallraven C; Bülthoff HH
    J Vis; 2010 Sep; 10(11):2. PubMed ID: 20884497
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 8.