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 *

448 related articles for article (PubMed ID: 29594779)

  • 21. Creating the New from the Old: Combinatorial Libraries Generation with Machine-Learning-Based Compound Structure Optimization.
    Podlewska S; Czarnecki WM; Kafel R; Bojarski AJ
    J Chem Inf Model; 2017 Feb; 57(2):133-147. PubMed ID: 28158942
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Virtual screen for ligands of orphan G protein-coupled receptors.
    Bock JR; Gough DA
    J Chem Inf Model; 2005; 45(5):1402-14. PubMed ID: 16180917
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Protection of Primary Dopaminergic Midbrain Neurons Through Impact of Small Molecules Using Virtual Screening of GPR139 Supported by Molecular Dynamic Simulation and Systems Biology.
    Kaushik AC; Gautam D; Nangraj AS; Wei DQ; Sahi S
    Interdiscip Sci; 2019 Jun; 11(2):247-257. PubMed ID: 31177377
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Structure-based discovery of novel US28 small molecule ligands with different modes of action.
    Lückmann M; Amarandi RM; Papargyri N; Jakobsen MH; Christiansen E; Jensen LJ; Pui A; Schwartz TW; Rosenkilde MM; Frimurer TM
    Chem Biol Drug Des; 2017 Mar; 89(3):289-296. PubMed ID: 27569905
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Pharmaceutical Machine Learning: Virtual High-Throughput Screens Identifying Promising and Economical Small Molecule Inhibitors of Complement Factor C1s.
    Chen JJ; Schmucker LN; Visco DP
    Biomolecules; 2018 May; 8(2):. PubMed ID: 29735903
    [TBL] [Abstract][Full Text] [Related]  

  • 26. GPCR profiling: from hits to leads and from genotype to phenotype.
    Cvijic ME; Sum CS; Alt A; Zhang L
    Drug Discov Today Technol; 2015 Nov; 18():30-7. PubMed ID: 26723890
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Virtual screening of biogenic amine-binding G-protein coupled receptors: comparative evaluation of protein- and ligand-based virtual screening protocols.
    Evers A; Hessler G; Matter H; Klabunde T
    J Med Chem; 2005 Aug; 48(17):5448-65. PubMed ID: 16107144
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Designing Multi-target Compound Libraries with Gaussian Process Models.
    Bieler M; Reutlinger M; Rodrigues T; Schneider P; Kriegl JM; Schneider G
    Mol Inform; 2016 May; 35(5):192-8. PubMed ID: 27492085
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Multiple machine learning based descriptive and predictive workflow for the identification of potential PTP1B inhibitors.
    Chandra S; Pandey J; Tamrakar AK; Siddiqi MI
    J Mol Graph Model; 2017 Jan; 71():242-256. PubMed ID: 28006676
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Virtual high throughput screening using combined random forest and flexible docking.
    Plewczynski D; von Grotthuss M; Rychlewski L; Ginalski K
    Comb Chem High Throughput Screen; 2009 Jun; 12(5):484-9. PubMed ID: 19519327
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Emerging Approaches to GPCR Ligand Screening for Drug Discovery.
    Kumari P; Ghosh E; Shukla AK
    Trends Mol Med; 2015 Nov; 21(11):687-701. PubMed ID: 26481827
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Methods for Virtual Screening of GPCR Targets: Approaches and Challenges.
    Cross JB
    Methods Mol Biol; 2018; 1705():233-264. PubMed ID: 29188566
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Structure-based virtual screening of vast chemical space as a starting point for drug discovery.
    Carlsson J; Luttens A
    Curr Opin Struct Biol; 2024 Aug; 87():102829. PubMed ID: 38848655
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Homology model-based virtual screening for GPCR ligands using docking and target-biased scoring.
    Radestock S; Weil T; Renner S
    J Chem Inf Model; 2008 May; 48(5):1104-17. PubMed ID: 18442221
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Improving virtual screening of G protein-coupled receptors via ligand-directed modeling.
    Coudrat T; Simms J; Christopoulos A; Wootten D; Sexton PM
    PLoS Comput Biol; 2017 Nov; 13(11):e1005819. PubMed ID: 29131821
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Characterizing common substructures of ligands for GPCR protein subfamilies.
    Erguner B; Hattori M; Goto S; Kanehisa M
    Genome Inform; 2010; 24():31-41. PubMed ID: 22081587
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Cheminformatics in the Service of GPCR Drug Discovery.
    James T
    Methods Mol Biol; 2018; 1705():395-411. PubMed ID: 29188575
    [TBL] [Abstract][Full Text] [Related]  

  • 38. An efficient multistep ligand-based virtual screening approach for GPR40 agonists.
    Yao S; Lu T; Zhou Z; Liu H; Yuan H; Ran T; Lu S; Zhang Y; Ke Z; Xu J; Xiong X; Chen Y
    Mol Divers; 2014 Feb; 18(1):183-93. PubMed ID: 24307222
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Time-resolved FRET strategy to screen GPCR ligand library.
    Oueslati N; Hounsou C; Belhocine A; Rodriguez T; Dupuis E; Zwier JM; Trinquet E; Pin JP; Durroux T
    Methods Mol Biol; 2015; 1272():23-36. PubMed ID: 25563174
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Binary classification of a large collection of environmental chemicals from estrogen receptor assays by quantitative structure-activity relationship and machine learning methods.
    Zang Q; Rotroff DM; Judson RS
    J Chem Inf Model; 2013 Dec; 53(12):3244-61. PubMed ID: 24279462
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 23.