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 *

321 related articles for article (PubMed ID: 34147204)

  • 1. Use of molecular docking computational tools in drug discovery.
    Stanzione F; Giangreco I; Cole JC
    Prog Med Chem; 2021; 60():273-343. PubMed ID: 34147204
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Advancements in Docking and Molecular Dynamics Simulations Towards Ligand-receptor Interactions and Structure-function Relationships.
    Naqvi AAT; Mohammad T; Hasan GM; Hassan MI
    Curr Top Med Chem; 2018; 18(20):1755-1768. PubMed ID: 30360721
    [TBL] [Abstract][Full Text] [Related]  

  • 3. ProSelection: A Novel Algorithm to Select Proper Protein Structure Subsets for in Silico Target Identification and Drug Discovery Research.
    Wang N; Wang L; Xie XQ
    J Chem Inf Model; 2017 Nov; 57(11):2686-2698. PubMed ID: 29016123
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Importance of molecular computer modeling in anticancer drug development.
    Geromichalos GD
    J BUON; 2007 Sep; 12 Suppl 1():S101-18. PubMed ID: 17935268
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Exploring the potential of global protein-protein docking: an overview and critical assessment of current programs for automatic ab initio docking.
    Huang SY
    Drug Discov Today; 2015 Aug; 20(8):969-77. PubMed ID: 25801181
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Docking and Virtual Screening in Drug Discovery.
    Kontoyianni M
    Methods Mol Biol; 2017; 1647():255-266. PubMed ID: 28809009
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Practices in Molecular Docking and Structure-Based Virtual Screening.
    Dos Santos RN; Ferreira LG; Andricopulo AD
    Methods Mol Biol; 2018; 1762():31-50. PubMed ID: 29594766
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Molecular docking for drug discovery and development: a widely used approach but far from perfect.
    Wang G; Zhu W
    Future Med Chem; 2016 Sep; 8(14):1707-10. PubMed ID: 27578269
    [No Abstract]   [Full Text] [Related]  

  • 9. 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]  

  • 10. Protein structure-based drug design: from docking to molecular dynamics.
    Śledź P; Caflisch A
    Curr Opin Struct Biol; 2018 Feb; 48():93-102. PubMed ID: 29149726
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Advances in the Treatment of Explicit Water Molecules in Docking and Binding Free Energy Calculations.
    Hu X; Maffucci I; Contini A
    Curr Med Chem; 2019; 26(42):7598-7622. PubMed ID: 29756561
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Essential considerations for using protein-ligand structures in drug discovery.
    Warren GL; Do TD; Kelley BP; Nicholls A; Warren SD
    Drug Discov Today; 2012 Dec; 17(23-24):1270-81. PubMed ID: 22728777
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Binding Mode Prediction and Virtual Screening Applications by Covalent Docking.
    Scarpino A; Ferenczy GG; Keserű GM
    Methods Mol Biol; 2021; 2266():73-88. PubMed ID: 33759121
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Automated docking for novel drug discovery.
    Bello M; Martínez-Archundia M; Correa-Basurto J
    Expert Opin Drug Discov; 2013 Jul; 8(7):821-34. PubMed ID: 23642085
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Assessing and improving the performance of consensus docking strategies using the DockBox package.
    Preto J; Gentile F
    J Comput Aided Mol Des; 2019 Sep; 33(9):817-829. PubMed ID: 31578656
    [TBL] [Abstract][Full Text] [Related]  

  • 16. The Art and Science of Molecular Docking.
    Paggi JM; Pandit A; Dror RO
    Annu Rev Biochem; 2024 Aug; 93(1):389-410. PubMed ID: 38594926
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Machine learning in computational docking.
    Khamis MA; Gomaa W; Ahmed WF
    Artif Intell Med; 2015 Mar; 63(3):135-52. PubMed ID: 25724101
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Use of machine learning approaches for novel drug discovery.
    Lima AN; Philot EA; Trossini GH; Scott LP; Maltarollo VG; Honorio KM
    Expert Opin Drug Discov; 2016; 11(3):225-39. PubMed ID: 26814169
    [TBL] [Abstract][Full Text] [Related]  

  • 19. HybridDock: A Hybrid Protein-Ligand Docking Protocol Integrating Protein- and Ligand-Based Approaches.
    Huang SY; Li M; Wang J; Pan Y
    J Chem Inf Model; 2016 Jun; 56(6):1078-87. PubMed ID: 26317502
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Forging the Basis for Developing Protein-Ligand Interaction Scoring Functions.
    Liu Z; Su M; Han L; Liu J; Yang Q; Li Y; Wang R
    Acc Chem Res; 2017 Feb; 50(2):302-309. PubMed ID: 28182403
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 17.