BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

112 related articles for article (PubMed ID: 28406291)

  • 21. Solution structure of Ln(III) complexes with macrocyclic ligands through theoretical evaluation of 1H NMR contact shifts.
    Rodríguez-Rodríguez A; Esteban-Gómez D; de Blas A; Rodríguez-Blas T; Botta M; Tripier R; Platas-Iglesias C
    Inorg Chem; 2012 Dec; 51(24):13419-29. PubMed ID: 23215456
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Combining weak affinity chromatography, NMR spectroscopy and molecular simulations in carbohydrate-lysozyme interaction studies.
    Landström J; Bergström M; Hamark C; Ohlson S; Widmalm G
    Org Biomol Chem; 2012 Apr; 10(15):3019-32. PubMed ID: 22395160
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Protein-ligand structure guided by backbone and side-chain proton chemical shift perturbations.
    Aguirre C; ten Brink T; Cala O; Guichou JF; Krimm I
    J Biomol NMR; 2014 Nov; 60(2-3):147-56. PubMed ID: 25256941
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Bile salt recognition by human liver fatty acid binding protein.
    Favretto F; Santambrogio C; D'Onofrio M; Molinari H; Grandori R; Assfalg M
    FEBS J; 2015 Apr; 282(7):1271-88. PubMed ID: 25639618
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Ligand-receptor binding affinities from saturation transfer difference (STD) NMR spectroscopy: the binding isotherm of STD initial growth rates.
    Angulo J; Enríquez-Navas PM; Nieto PM
    Chemistry; 2010 Jul; 16(26):7803-12. PubMed ID: 20496354
    [TBL] [Abstract][Full Text] [Related]  

  • 26. A general and fast scoring function for protein-ligand interactions: a simplified potential approach.
    Muegge I; Martin YC
    J Med Chem; 1999 Mar; 42(5):791-804. PubMed ID: 10072678
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Improving docking results via reranking of ensembles of ligand poses in multiple X-ray protein conformations with MM-GBSA.
    Greenidge PA; Kramer C; Mozziconacci JC; Sherman W
    J Chem Inf Model; 2014 Oct; 54(10):2697-717. PubMed ID: 25266271
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Comparison of molecular mechanics, semi-empirical quantum mechanical, and density functional theory methods for scoring protein-ligand interactions.
    Yilmazer ND; Korth M
    J Phys Chem B; 2013 Jul; 117(27):8075-84. PubMed ID: 23758433
    [TBL] [Abstract][Full Text] [Related]  

  • 29. NMR investigations of protein-carbohydrate interactions: studies on the relevance of Trp/Tyr variations in lectin binding sites as deduced from titration microcalorimetry and NMR studies on hevein domains. Determination of the NMR structure of the complex between pseudohevein and N,N',N"-triacetylchitotriose.
    Asensio JL; Siebert HC; von Der Lieth CW; Laynez J; Bruix M; Soedjanaamadja UM; Beintema JJ; Cañada FJ; Gabius HJ; Jiménez-Barbero J
    Proteins; 2000 Aug; 40(2):218-36. PubMed ID: 10842338
    [TBL] [Abstract][Full Text] [Related]  

  • 30. CORCEMA refinement of the bound ligand conformation within the protein binding pocket in reversibly forming weak complexes using STD-NMR intensities.
    Jayalakshmi V; Rama Krishna N
    J Magn Reson; 2004 May; 168(1):36-45. PubMed ID: 15082247
    [TBL] [Abstract][Full Text] [Related]  

  • 31. High relaxivity supramolecular adducts between human-liver fatty-acid-binding protein and amphiphilic Gd(III) complexes: structural basis for the design of intracellular targeting MRI probes.
    D'Onofrio M; Gianolio E; Ceccon A; Arena F; Zanzoni S; Fushman D; Aime S; Molinari H; Assfalg M
    Chemistry; 2012 Aug; 18(32):9919-28. PubMed ID: 22763949
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Protein NMR chemical shift calculations based on the automated fragmentation QM/MM approach.
    He X; Wang B; Merz KM
    J Phys Chem B; 2009 Jul; 113(30):10380-8. PubMed ID: 19575540
    [TBL] [Abstract][Full Text] [Related]  

  • 33. HarmonyDOCK: the structural analysis of poses in protein-ligand docking.
    Plewczynski D; Philips A; Von Grotthuss M; Rychlewski L; Ginalski K
    J Comput Biol; 2014 Mar; 21(3):247-56. PubMed ID: 21091053
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Investigation of MM-PBSA rescoring of docking poses.
    Thompson DC; Humblet C; Joseph-McCarthy D
    J Chem Inf Model; 2008 May; 48(5):1081-91. PubMed ID: 18465849
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Spatial localization of ligand binding sites from electron current density surfaces calculated from NMR chemical shift perturbations.
    McCoy MA; Wyss DF
    J Am Chem Soc; 2002 Oct; 124(39):11758-63. PubMed ID: 12296743
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Structural basis for the ligand-binding specificity of fatty acid-binding proteins (pFABP4 and pFABP5) in gentoo penguin.
    Lee CW; Kim JE; Do H; Kim RO; Lee SG; Park HH; Chang JH; Yim JH; Park H; Kim IC; Lee JH
    Biochem Biophys Res Commun; 2015 Sep; 465(1):12-8. PubMed ID: 26206084
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Large-scale validation of a quantum mechanics based scoring function: predicting the binding affinity and the binding mode of a diverse set of protein-ligand complexes.
    Raha K; Merz KM
    J Med Chem; 2005 Jul; 48(14):4558-75. PubMed ID: 15999994
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Synthesis, structure, DFT calculations, electrochemistry, fluorescence, DNA binding and molecular docking aspects of a novel oxime based ligand and its palladium(II) complex.
    Bandyopadhyay N; Pradhan AB; Das S; Lu L; Zhu M; Chowdhury S; Naskar JP
    J Photochem Photobiol B; 2016 Jul; 160():336-46. PubMed ID: 27179300
    [TBL] [Abstract][Full Text] [Related]  

  • 39. An NMR Method To Pinpoint Supramolecular Ligand Binding to Basic Residues on Proteins.
    Hogeweg A; Sowislok A; Schrader T; Beuck C
    Angew Chem Int Ed Engl; 2017 Nov; 56(46):14758-14762. PubMed ID: 28877391
    [TBL] [Abstract][Full Text] [Related]  

  • 40. E-novo: an automated workflow for efficient structure-based lead optimization.
    Pearce BC; Langley DR; Kang J; Huang H; Kulkarni A
    J Chem Inf Model; 2009 Jul; 49(7):1797-809. PubMed ID: 19552372
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 6.