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 *

176 related articles for article (PubMed ID: 39146197)

  • 1. On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors.
    Pacoste L; Ignat'ev VM; Dominiak PM; Zou X
    IUCrJ; 2024 Sep; 11(Pt 5):878-890. PubMed ID: 39146197
    [TBL] [Abstract][Full Text] [Related]  

  • 2. TAAM refinement on high-resolution experimental and simulated 3D ED/MicroED data for organic molecules.
    Kumar A; Jha KK; Olech B; Goral T; Malinska M; Woźniak K; Dominiak PM
    Acta Crystallogr C Struct Chem; 2024 Jul; 80(Pt 7):264-277. PubMed ID: 38934273
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Dynamical refinement with multipolar electron scattering factors.
    Olech B; Brázda P; Palatinus L; Dominiak PM
    IUCrJ; 2024 May; 11(Pt 3):309-324. PubMed ID: 38512772
    [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. Refinement of organic crystal structures with multipolar electron scattering factors.
    Gruza B; Chodkiewicz ML; Krzeszczakowska J; Dominiak PM
    Acta Crystallogr A Found Adv; 2020 Jan; 76(Pt 1):92-109. PubMed ID: 31908353
    [TBL] [Abstract][Full Text] [Related]  

  • 6. 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]  

  • 7. Electron density is not spherical: the many applications of the transferable aspherical atom model.
    Kulik M; Dominiak PM
    Comput Struct Biotechnol J; 2022; 20():6237-6243. PubMed ID: 36420158
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Theoretical 3D electron diffraction electrostatic potential maps of proteins modeled with a multipolar pseudoatom data bank.
    Kulik M; Chodkiewicz ML; Dominiak PM
    Acta Crystallogr D Struct Biol; 2022 Aug; 78(Pt 8):1010-1020. PubMed ID: 35916225
    [TBL] [Abstract][Full Text] [Related]  

  • 9. 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]  

  • 10. Extension of the transferable aspherical pseudoatom data bank for the comparison of molecular electrostatic potentials in structure-activity studies.
    Kumar P; Gruza B; Bojarowski SA; Dominiak PM
    Acta Crystallogr A Found Adv; 2019 Mar; 75(Pt 2):398-408. PubMed ID: 30821272
    [TBL] [Abstract][Full Text] [Related]  

  • 11. On the accuracy and precision of X-ray and neutron diffraction results as a function of resolution and the electron density model.
    Sanjuan-Szklarz WF; Woińska M; Domagała S; Dominiak PM; Grabowsky S; Jayatilaka D; Gutmann M; Woźniak K
    IUCrJ; 2020 Sep; 7(Pt 5):920-933. PubMed ID: 32939284
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Yes, one can obtain better quality structures from routine X-ray data collection.
    Sanjuan-Szklarz WF; Hoser AA; Gutmann M; Madsen AØ; Woźniak K
    IUCrJ; 2016 Jan; 3(Pt 1):61-70. PubMed ID: 26870382
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Transferable aspherical atom model refinement of protein and DNA structures against ultrahigh-resolution X-ray data.
    Malinska M; Dauter Z
    Acta Crystallogr D Struct Biol; 2016 Jun; 72(Pt 6):770-9. PubMed ID: 27303797
    [TBL] [Abstract][Full Text] [Related]  

  • 14. 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]  

  • 15. Transferable Hirshfeld atom model for rapid evaluation of aspherical atomic form factors.
    Chodkiewicz M; Patrikeev L; Pawlędzio S; Woźniak K
    IUCrJ; 2024 Mar; 11(Pt 2):249-259. PubMed ID: 38446457
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Verification of structural and electrostatic properties obtained by the use of different pseudoatom databases.
    Bąk JM; Domagała S; Hübschle C; Jelsch C; Dittrich B; Dominiak PM
    Acta Crystallogr A; 2011 Mar; 67(Pt 2):141-53. PubMed ID: 21325717
    [TBL] [Abstract][Full Text] [Related]  

  • 17. 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]  

  • 18. 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]  

  • 19. 3D electron diffraction goes multipolar.
    Beanland R
    IUCrJ; 2024 May; 11(Pt 3):277-278. PubMed ID: 38700231
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Multipolar Atom Types from Theory and Statistical Clustering (MATTS) Data Bank: Restructurization and Extension of UBDB.
    Jha KK; Gruza B; Sypko A; Kumar P; Chodkiewicz ML; Dominiak PM
    J Chem Inf Model; 2022 Aug; 62(16):3752-3765. PubMed ID: 35943747
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.