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 *

1060 related articles for article (PubMed ID: 25618350)

  • 1. Small-molecule library screening by docking with PyRx.
    Dallakyan S; Olson AJ
    Methods Mol Biol; 2015; 1263():243-50. PubMed ID: 25618350
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Applications of the NRGsuite and the Molecular Docking Software FlexAID in Computational Drug Discovery and Design.
    Morency LP; Gaudreault F; Najmanovich R
    Methods Mol Biol; 2018; 1762():367-388. PubMed ID: 29594781
    [TBL] [Abstract][Full Text] [Related]  

  • 3. FlexAID: Revisiting Docking on Non-Native-Complex Structures.
    Gaudreault F; Najmanovich RJ
    J Chem Inf Model; 2015 Jul; 55(7):1323-36. PubMed ID: 26076070
    [TBL] [Abstract][Full Text] [Related]  

  • 4. WinDock: structure-based drug discovery on Windows-based PCs.
    Hu Z; Southerland W
    J Comput Chem; 2007 Nov; 28(14):2347-51. PubMed ID: 17476686
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Insilico Approaches in Anesthetic Drug Development: Computer Aided Drug Designing.
    Peng QX; Guan XH; Yi ZG; Su YP
    Drug Res (Stuttg); 2015 Nov; 65(11):587-91. PubMed ID: 25463595
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Identification of ALK5 inhibitor via structure-based virtual screening and ADMET prediction.
    Lin A; Cai Z; Hu G; Li Q
    J Recept Signal Transduct Res; 2015; 35(6):559-64. PubMed ID: 26042458
    [TBL] [Abstract][Full Text] [Related]  

  • 7. State-of-the-art technology in modern computer-aided drug design.
    Dalkas GA; Vlachakis D; Tsagkrasoulis D; Kastania A; Kossida S
    Brief Bioinform; 2013 Nov; 14(6):745-52. PubMed ID: 23148324
    [TBL] [Abstract][Full Text] [Related]  

  • 8. In silico design of small molecules.
    Bernardo PH; Tong JC
    Methods Mol Biol; 2012; 800():25-31. PubMed ID: 21964780
    [TBL] [Abstract][Full Text] [Related]  

  • 9. SEABED: Small molEcule activity scanner weB servicE baseD.
    Fenollosa C; Otón M; Andrio P; Cortés J; Orozco M; Goñi JR
    Bioinformatics; 2015 Mar; 31(5):773-5. PubMed ID: 25348211
    [TBL] [Abstract][Full Text] [Related]  

  • 10. DockingApp: a user friendly interface for facilitated docking simulations with AutoDock Vina.
    Di Muzio E; Toti D; Polticelli F
    J Comput Aided Mol Des; 2017 Feb; 31(2):213-218. PubMed ID: 28063067
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Boosting Docking-Based Virtual Screening with Deep Learning.
    Pereira JC; Caffarena ER; Dos Santos CN
    J Chem Inf Model; 2016 Dec; 56(12):2495-2506. PubMed ID: 28024405
    [TBL] [Abstract][Full Text] [Related]  

  • 12. In silico fragment-based drug discovery: setup and validation of a fragment-to-lead computational protocol using S4MPLE.
    Hoffer L; Renaud JP; Horvath D
    J Chem Inf Model; 2013 Apr; 53(4):836-51. PubMed ID: 23537132
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Structure-Based Virtual Screening of Commercially Available Compound Libraries.
    Kireev D
    Methods Mol Biol; 2016; 1439():65-76. PubMed ID: 27316988
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Enrichment assessment of multiple virtual screening strategies for Toll-like receptor 8 agonists based on a maximal unbiased benchmarking data set.
    Pei F; Jin H; Zhou X; Xia J; Sun L; Liu Z; Zhang L
    Chem Biol Drug Des; 2015 Nov; 86(5):1226-41. PubMed ID: 26017460
    [TBL] [Abstract][Full Text] [Related]  

  • 15. VSPrep: A General KNIME Workflow for the Preparation of Molecules for Virtual Screening.
    Gally JM; Bourg S; Do QT; Aci-Sèche S; Bonnet P
    Mol Inform; 2017 Oct; 36(10):. PubMed ID: 28586180
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Computer-aided drug discovery research at a global contract research organization.
    Kitchen DB
    J Comput Aided Mol Des; 2017 Mar; 31(3):309-318. PubMed ID: 27804014
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Recent advances in computer-aided drug design.
    Song CM; Lim SJ; Tong JC
    Brief Bioinform; 2009 Sep; 10(5):579-91. PubMed ID: 19433475
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Structure-based computational approaches for small-molecule modulation of protein-protein interactions.
    Xu D; Wang B; Meroueh SO
    Methods Mol Biol; 2015; 1278():77-92. PubMed ID: 25859944
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Molecular dynamics in drug design.
    Zhao H; Caflisch A
    Eur J Med Chem; 2015 Feb; 91():4-14. PubMed ID: 25108504
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Molecular docking to flexible targets.
    Sørensen J; Demir Ö; Swift RV; Feher VA; Amaro RE
    Methods Mol Biol; 2015; 1215():445-69. PubMed ID: 25330975
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 53.