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 *

132 related articles for article (PubMed ID: 37357682)

  • 1. Hirshfeld atom refinement of metal-organic frameworks for accurate positioning of hydrogen atoms and disorder analysis.
    Xu Y; Chodkiewicz ML; Woińska M; Trzybiński D; Brekalo I; Topić F; Woźniak K; Arhangelskis M
    Chem Commun (Camb); 2023 Jul; 59(57):8799-8802. PubMed ID: 37357682
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Hydrogen atoms can be located accurately and precisely by x-ray crystallography.
    Woińska M; Grabowsky S; Dominiak PM; Woźniak K; Jayatilaka D
    Sci Adv; 2016 May; 2(5):e1600192. PubMed ID: 27386545
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Accurate crystal structure of ice VI from X-ray diffraction with Hirshfeld atom refinement.
    Chodkiewicz ML; Gajda R; Lavina B; Tkachev S; Prakapenka VB; Dera P; Wozniak K
    IUCrJ; 2022 Sep; 9(Pt 5):573-579. PubMed ID: 36071798
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Aspherical atom refinements on X-ray data of diverse structures including disordered and covalent organic framework systems: a time-accuracy trade-off.
    Jha KK; Kleemiss F; Chodkiewicz ML; Dominiak PM
    J Appl Crystallogr; 2023 Feb; 56(Pt 1):116-127. PubMed ID: 36777135
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Hirshfeld Atom Refinement of Metal-Organic Complexes: Treatment of Hydrogen Atoms Bonded to Transition Metals.
    Woińska M; Pawlędzio S; Chodkiewicz ML; Woźniak K
    J Phys Chem A; 2023 Apr; 127(13):3020-3035. PubMed ID: 36947670
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Hirshfeld atom refinement.
    Capelli SC; Bürgi HB; Dittrich B; Grabowsky S; Jayatilaka D
    IUCrJ; 2014 Sep; 1(Pt 5):361-79. PubMed ID: 25295177
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Hirshfeld atom refinement for modelling strong hydrogen bonds.
    Woińska M; Jayatilaka D; Spackman MA; Edwards AJ; Dominiak PM; Woźniak K; Nishibori E; Sugimoto K; Grabowsky S
    Acta Crystallogr A Found Adv; 2014 Sep; 70(Pt 5):483-98. PubMed ID: 25176996
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Enhancing hydrogen positions in X-ray structures of transition metal hydride complexes with dynamic quantum crystallography.
    Woińska M; Hoser AA; Chodkiewicz ML; Woźniak K
    IUCrJ; 2024 Jan; 11(Pt 1):45-56. PubMed ID: 37990870
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Probing the accuracy and precision of Hirshfeld atom refinement with
    Fugel M; Jayatilaka D; Hupf E; Overgaard J; Hathwar VR; Macchi P; Turner MJ; Howard JAK; Dolomanov OV; Puschmann H; Iversen BB; Bürgi HB; Grabowsky S
    IUCrJ; 2018 Jan; 5(Pt 1):32-44. PubMed ID: 29354269
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method.
    Ramadhar TR; Zheng SL; Chen YS; Clardy J
    Acta Crystallogr A Found Adv; 2015 Jan; 71(Pt 1):46-58. PubMed ID: 25537388
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Hydrogen ADPs with Cu Kα data? Invariom and Hirshfeld atom modelling of fluconazole.
    Orben CM; Dittrich B
    Acta Crystallogr C Struct Chem; 2014 Jun; 70(Pt 6):580-3. PubMed ID: 24898961
    [TBL] [Abstract][Full Text] [Related]  

  • 12. TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data.
    Jha KK; Gruza B; Kumar P; Chodkiewicz ML; Dominiak PM
    Acta Crystallogr B Struct Sci Cryst Eng Mater; 2020 Jun; 76(Pt 3):296-306. PubMed ID: 32831250
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Comparison of different strategies for modelling hydrogen atoms in charge density analyses.
    Köhler C; Lübben J; Krause L; Hoffmann C; Herbst-Irmer R; Stalke D
    Acta Crystallogr B Struct Sci Cryst Eng Mater; 2019 Jun; 75(Pt 3):434-441. PubMed ID: 32830665
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Electron density, disorder and polymorphism: high-resolution diffraction studies of the highly polymorphic neuralgic drug carbamazepine.
    Sovago I; Gutmann MJ; Senn HM; Thomas LH; Wilson CC; Farrugia LJ
    Acta Crystallogr B Struct Sci Cryst Eng Mater; 2016 Feb; 72(Pt 1):39-50. PubMed ID: 26830795
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Hirshfeld atom like refinement with alternative electron density partitions.
    Chodkiewicz ML; Woińska M; Woźniak K
    IUCrJ; 2020 Nov; 7(Pt 6):1199-1215. PubMed ID: 33209330
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.
    Woińska M; Chodkiewicz ML; Woźniak K
    Chem Commun (Camb); 2021 Apr; 57(30):3652-3655. PubMed ID: 33870351
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Fragmentation and transferability in Hirshfeld atom refinement.
    Chodkiewicz M; Pawlędzio S; Woińska M; Woźniak K
    IUCrJ; 2022 Mar; 9(Pt 2):298-315. PubMed ID: 35371499
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data.
    Chodkiewicz ML; Olech B; Jha KK; Dominiak PM; Woźniak K
    IUCrJ; 2024 Sep; 11(Pt 5):730-736. PubMed ID: 39078666
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Further Validation of Quantum Crystallography Approaches.
    Wanat M; Malinska M; Hoser AA; Woźniak K
    Molecules; 2021 Jun; 26(12):. PubMed ID: 34207308
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Accurate Bond Lengths to Hydrogen Atoms from Single-Crystal X-ray Diffraction by Including Estimated Hydrogen ADPs and Comparison to Neutron and QM/MM Benchmarks.
    Dittrich B; Lübben J; Mebs S; Wagner A; Luger P; Flaig R
    Chemistry; 2017 Apr; 23(19):4605-4614. PubMed ID: 28295691
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 7.