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 *

245 related articles for article (PubMed ID: 24072554)

  • 41. The evaluation of QM/MM-driven molecular docking combined with MM/GBSA calculations as a halogen-bond scoring strategy.
    Kurczab R
    Acta Crystallogr B Struct Sci Cryst Eng Mater; 2017 Apr; 73(Pt 2):188-194. PubMed ID: 28362281
    [TBL] [Abstract][Full Text] [Related]  

  • 42. Halogen Bonds in Ligand-Protein Systems: Molecular Orbital Theory for Drug Design.
    Margiotta E; van der Lubbe SCC; de Azevedo Santos L; Paragi G; Moro S; Bickelhaupt FM; Fonseca Guerra C
    J Chem Inf Model; 2020 Mar; 60(3):1317-1328. PubMed ID: 32003997
    [TBL] [Abstract][Full Text] [Related]  

  • 43. Converging a Knowledge-Based Scoring Function: DrugScore
    Dittrich J; Schmidt D; Pfleger C; Gohlke H
    J Chem Inf Model; 2019 Jan; 59(1):509-521. PubMed ID: 30513206
    [TBL] [Abstract][Full Text] [Related]  

  • 44. The Significance of Halogen Bonding in Ligand-Receptor Interactions: The Lesson Learned from Molecular Dynamic Simulations of the D
    Kurczab R; Kucwaj-Brysz K; Śliwa P
    Molecules; 2019 Dec; 25(1):. PubMed ID: 31881785
    [TBL] [Abstract][Full Text] [Related]  

  • 45. Replacement of Protein Binding-Site Waters Contributes to Favorable Halogen Bond Interactions.
    Wang Y; Fu Q; Zhou Y; Du Y; Huang N
    J Chem Inf Model; 2019 Jul; 59(7):3136-3143. PubMed ID: 31187992
    [TBL] [Abstract][Full Text] [Related]  

  • 46. An iterative knowledge-based scoring function to predict protein-ligand interactions: I. Derivation of interaction potentials.
    Huang SY; Zou X
    J Comput Chem; 2006 Nov; 27(15):1866-75. PubMed ID: 16983673
    [TBL] [Abstract][Full Text] [Related]  

  • 47. Thermodynamics of halogen bonding in solution: substituent, structural, and solvent effects.
    Sarwar MG; Dragisic B; Salsberg LJ; Gouliaras C; Taylor MS
    J Am Chem Soc; 2010 Feb; 132(5):1646-53. PubMed ID: 20078063
    [TBL] [Abstract][Full Text] [Related]  

  • 48. AA-Score: a New Scoring Function Based on Amino Acid-Specific Interaction for Molecular Docking.
    Pan X; Wang H; Zhang Y; Wang X; Li C; Ji C; Zhang JZH
    J Chem Inf Model; 2022 May; 62(10):2499-2509. PubMed ID: 35452230
    [TBL] [Abstract][Full Text] [Related]  

  • 49. Revealing halogen bonding interactions with anomeric systems: an ab initio quantum chemical studies.
    Lo R; Ganguly B
    J Mol Graph Model; 2015 Feb; 55():123-33. PubMed ID: 25522359
    [TBL] [Abstract][Full Text] [Related]  

  • 50. Structural, Theoretical Analysis, and Molecular Docking of Two Benzamide Isomers. Halogen Bonding and Its Role in the Diverse Ways of Coupling with Protein Residues.
    Moreno-Fuquen R; García-Torres E; Arango-Daraviña K; Ellena J
    Chem Pharm Bull (Tokyo); 2022; 70(11):782-790. PubMed ID: 36328520
    [TBL] [Abstract][Full Text] [Related]  

  • 51. Halogen bonding--a novel interaction for rational drug design?
    Lu Y; Shi T; Wang Y; Yang H; Yan X; Luo X; Jiang H; Zhu W
    J Med Chem; 2009 May; 52(9):2854-62. PubMed ID: 19358610
    [TBL] [Abstract][Full Text] [Related]  

  • 52. An Unprecedented Interconversion Between Non-covalent and Covalent Interactions Driven by Halogen Bonding.
    Jiang X; Miao J; Gao Y
    Chemphyschem; 2022 May; 23(9):e202200001. PubMed ID: 35266268
    [TBL] [Abstract][Full Text] [Related]  

  • 53. Iterative Knowledge-Based Scoring Function for Protein-Ligand Interactions by Considering Binding Affinity Information.
    Zhao X; Li H; Zhang K; Huang SY
    J Phys Chem B; 2023 Oct; 127(42):9021-9034. PubMed ID: 37822259
    [TBL] [Abstract][Full Text] [Related]  

  • 54. Ab initio investigation of the complexes between bromobenzene and several electron donors: some insights into the magnitude and nature of halogen bonding interactions.
    Lu YX; Zou JW; Wang YH; Jiang YJ; Yu QS
    J Phys Chem A; 2007 Oct; 111(42):10781-8. PubMed ID: 17918810
    [TBL] [Abstract][Full Text] [Related]  

  • 55. Enhancing effects of electron-withdrawing groups and metallic ions on halogen bonding in the YC6F4X···C2H8N2 (X = Cl, Br, I; Y = F, CN, NO2, LiNC+, NaNC+) complex.
    Han N; Zeng Y; Li X; Zheng S; Meng L
    J Phys Chem A; 2013 Dec; 117(48):12959-68. PubMed ID: 24237250
    [TBL] [Abstract][Full Text] [Related]  

  • 56. Halogen bonding: an interim discussion.
    Politzer P; Murray JS
    Chemphyschem; 2013 Feb; 14(2):278-94. PubMed ID: 23303575
    [TBL] [Abstract][Full Text] [Related]  

  • 57. The role of molecular electrostatic potentials in the formation of a halogen bond in furan⋅⋅⋅XY and thiophene⋅⋅⋅XY complexes.
    Zeng Y; Zhang X; Li X; Meng L; Zheng S
    Chemphyschem; 2011 Apr; 12(6):1080-7. PubMed ID: 21432980
    [TBL] [Abstract][Full Text] [Related]  

  • 58. Competition between electrostatic interactions and halogen bonding in the protein-ligand system: structural and thermodynamic studies of 5,6-dibromobenzotriazole-hCK2α complexes.
    Winiewska-Szajewska M; Czapinska H; Kaus-Drobek M; Fricke A; Mieczkowska K; Dadlez M; Bochtler M; Poznański J
    Sci Rep; 2022 Nov; 12(1):18964. PubMed ID: 36347916
    [TBL] [Abstract][Full Text] [Related]  

  • 59. Halogen bonds as orthogonal molecular interactions to hydrogen bonds.
    Voth AR; Khuu P; Oishi K; Ho PS
    Nat Chem; 2009 Apr; 1(1):74-9. PubMed ID: 21378804
    [TBL] [Abstract][Full Text] [Related]  

  • 60. DrugScoreRNA--knowledge-based scoring function to predict RNA-ligand interactions.
    Pfeffer P; Gohlke H
    J Chem Inf Model; 2007; 47(5):1868-76. PubMed ID: 17705464
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 13.