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 *

160 related articles for article (PubMed ID: 29154440)

  • 21. Predictive cartography of metal binders using generative topographic mapping.
    Baskin II; Solov'ev VP; Bagatur'yants AA; Varnek A
    J Comput Aided Mol Des; 2017 Aug; 31(8):701-714. PubMed ID: 28688089
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Visualisation of the chemical space of fragments, lead-like and drug-like molecules in PubChem.
    van Deursen R; Blum LC; Reymond JL
    J Comput Aided Mol Des; 2011 Jul; 25(7):649-62. PubMed ID: 21618008
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Virtual exploration of the chemical universe up to 11 atoms of C, N, O, F: assembly of 26.4 million structures (110.9 million stereoisomers) and analysis for new ring systems, stereochemistry, physicochemical properties, compound classes, and drug discovery.
    Fink T; Reymond JL
    J Chem Inf Model; 2007; 47(2):342-53. PubMed ID: 17260980
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Exploring chemical space for drug discovery using the chemical universe database.
    Reymond JL; Awale M
    ACS Chem Neurosci; 2012 Sep; 3(9):649-57. PubMed ID: 23019491
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Generative Topographic Mapping of Conformational Space.
    Horvath D; Baskin I; Marcou G; Varnek A
    Mol Inform; 2017 Oct; 36(10):. PubMed ID: 28421706
    [TBL] [Abstract][Full Text] [Related]  

  • 26. How diverse are diversity assessment methods? A comparative analysis and benchmarking of molecular descriptor space.
    Koutsoukas A; Paricharak S; Galloway WR; Spring DR; Ijzerman AP; Glen RC; Marcus D; Bender A
    J Chem Inf Model; 2014 Jan; 54(1):230-42. PubMed ID: 24289493
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Progress in visual representations of chemical space.
    Osolodkin DI; Radchenko EV; Orlov AA; Voronkov AE; Palyulin VA; Zefirov NS
    Expert Opin Drug Discov; 2015; 10(9):959-73. PubMed ID: 26094796
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Generative Topographic Mapping (GTM): Universal Tool for Data Visualization, Structure-Activity Modeling and Dataset Comparison.
    Kireeva N; Baskin II; Gaspar HA; Horvath D; Marcou G; Varnek A
    Mol Inform; 2012 Apr; 31(3-4):301-12. PubMed ID: 27477099
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Visualization and virtual screening of the chemical universe database GDB-17.
    Ruddigkeit L; Blum LC; Reymond JL
    J Chem Inf Model; 2013 Jan; 53(1):56-65. PubMed ID: 23259841
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Fragment Database FDB-17.
    Visini R; Awale M; Reymond JL
    J Chem Inf Model; 2017 Apr; 57(4):700-709. PubMed ID: 28375006
    [TBL] [Abstract][Full Text] [Related]  

  • 31. CHIPMUNK: A Virtual Synthesizable Small-Molecule Library for Medicinal Chemistry, Exploitable for Protein-Protein Interaction Modulators.
    Humbeck L; Weigang S; Schäfer T; Mutzel P; Koch O
    ChemMedChem; 2018 Mar; 13(6):532-539. PubMed ID: 29392860
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Biodiversity of small molecules--a new perspective in screening set selection.
    Petrone PM; Wassermann AM; Lounkine E; Kutchukian P; Simms B; Jenkins J; Selzer P; Glick M
    Drug Discov Today; 2013 Jul; 18(13-14):674-80. PubMed ID: 23454345
    [TBL] [Abstract][Full Text] [Related]  

  • 33. FSees: Customized Enumeration of Chemical Subspaces with Limited Main Memory Consumption.
    Lauck F; Rarey M
    J Chem Inf Model; 2016 Sep; 56(9):1641-53. PubMed ID: 27617881
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Visual characterization and diversity quantification of chemical libraries: 1. creation of delimited reference chemical subspaces.
    Le Guilloux V; Colliandre L; Bourg S; Guénegou G; Dubois-Chevalier J; Morin-Allory L
    J Chem Inf Model; 2011 Aug; 51(8):1762-74. PubMed ID: 21761916
    [TBL] [Abstract][Full Text] [Related]  

  • 35. LEAP into the Pfizer Global Virtual Library (PGVL) space: creation of readily synthesizable design ideas automatically.
    Hu Q; Peng Z; Kostrowicki J; Kuki A
    Methods Mol Biol; 2011; 685():253-76. PubMed ID: 20981528
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Design of chemical libraries with potentially bioactive molecules applying a maximum common substructure concept.
    Lisurek M; Rupp B; Wichard J; Neuenschwander M; von Kries JP; Frank R; Rademann J; Kühne R
    Mol Divers; 2010 May; 14(2):401-8. PubMed ID: 19685275
    [TBL] [Abstract][Full Text] [Related]  

  • 37. The purchasable chemical space: a detailed picture.
    Lucas X; Grüning BA; Bleher S; Günther S
    J Chem Inf Model; 2015 May; 55(5):915-24. PubMed ID: 25894297
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Medicinal Chemistry Aware Database GDBMedChem.
    Awale M; Sirockin F; Stiefl N; Reymond JL
    Mol Inform; 2019 Aug; 38(8-9):e1900031. PubMed ID: 31169974
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Charting, navigating, and populating natural product chemical space for drug discovery.
    Lachance H; Wetzel S; Kumar K; Waldmann H
    J Med Chem; 2012 Jul; 55(13):5989-6001. PubMed ID: 22537178
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Chemspace Atlas: Multiscale Chemography of Ultralarge Libraries for Drug Discovery.
    Zabolotna Y; Bonachera F; Horvath D; Lin A; Marcou G; Klimchuk O; Varnek A
    J Chem Inf Model; 2022 Sep; 62(18):4537-4548. PubMed ID: 36103300
    [TBL] [Abstract][Full Text] [Related]  

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