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 *

148 related articles for article (PubMed ID: 37779962)

  • 21. Alkali and Alkaline-Earth Cations in Complexes with Small Bioorganic Ligands: Ab Initio Benchmark Calculations and Bond Energy Decomposition.
    López R; Díaz N; Suárez D
    Chemphyschem; 2020 Jan; 21(1):99-112. PubMed ID: 31674092
    [TBL] [Abstract][Full Text] [Related]  

  • 22. MP2-IQA: upscaling the analysis of topologically partitioned electron correlation.
    Silva AF; Popelier PLA
    J Mol Model; 2018 Jul; 24(8):201. PubMed ID: 29995194
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Electrostatics Explains the Reverse Lewis Acidity of BH
    Duarte LJ; Richter WE; Bruns RE; Popelier PLA
    J Phys Chem A; 2021 Oct; 125(39):8615-8625. PubMed ID: 34549960
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Does the Intra-Atomic Deformation Energy of Interacting Quantum Atoms Represent Steric Energy?
    Symons BCB; Williamson DJ; Brooks CM; Wilson AL; Popelier PLA
    ChemistryOpen; 2019 May; 8(5):560-570. PubMed ID: 31065506
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Interactions of boranes and carboranes with aromatic systems: CCSD(T) complete basis set calculations and DFT-SAPT analysis of energy components.
    Sedlák R; Fanfrlík J; Hnyk D; Hobza P; Lepsík M
    J Phys Chem A; 2010 Oct; 114(42):11304-11. PubMed ID: 20831237
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Protein-protein interfaces are vdW dominant with selective H-bonds and (or) electrostatics towards broad functional specificity.
    Nilofer C; Sukhwal A; Mohanapriya A; Kangueane P
    Bioinformation; 2017; 13(6):164-173. PubMed ID: 28729757
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Magnitude and nature of carbohydrate-aromatic interactions in fucose-phenol and fucose-indole complexes: CCSD(T) level interaction energy calculations.
    Tsuzuki S; Uchimaru T; Mikami M
    J Phys Chem A; 2011 Oct; 115(41):11256-62. PubMed ID: 21812469
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Hydrogen-hydrogen interaction in planar biphenyl: a theoretical study based on the interacting quantum atoms and Hirshfeld atomic energy partitioning methods.
    Eskandari K; Van Alsenoy C
    J Comput Chem; 2014 Oct; 35(26):1883-9. PubMed ID: 25074800
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Magnitude and directionality of the interaction energy of the aliphatic CH/pi interaction: significant difference from hydrogen bond.
    Tsuzuki S; Honda K; Uchimaru T; Mikami M; Fujii A
    J Phys Chem A; 2006 Aug; 110(33):10163-8. PubMed ID: 16913692
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Non-covalent interactions from a Quantum Chemical Topology perspective.
    Popelier PLA
    J Mol Model; 2022 Aug; 28(9):276. PubMed ID: 36006513
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Face-to-face stacks of trinuclear gold(I) trihalides with benzene, hexafluorobenzene, and borazine: impact of aromaticity on stacking interactions.
    Tsipis AC; Stalikas AV
    Inorg Chem; 2013 Jan; 52(2):1047-60. PubMed ID: 23270385
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Atomic Partitioning of the MPn (n = 2, 3, 4) Dynamic Electron Correlation Energy by the Interacting Quantum Atoms Method: A Fast and Accurate Electrostatic Potential Integral Approach.
    Vincent MA; Silva AF; Popelier PLA
    J Comput Chem; 2019 Dec; 40(32):2793-2800. PubMed ID: 31373709
    [TBL] [Abstract][Full Text] [Related]  

  • 33. An anatomy of intramolecular atomic interactions in halogen-substituted trinitromethanes.
    Bartashevich EV; Pendás ÁM; Tsirelson VG
    Phys Chem Chem Phys; 2014 Aug; 16(31):16780-9. PubMed ID: 25001471
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Exponential Relationships Capturing Atomistic Short-Range Repulsion from the Interacting Quantum Atoms (IQA) Method.
    Wilson AL; Popelier PL
    J Phys Chem A; 2016 Dec; 120(48):9647-9659. PubMed ID: 27933917
    [TBL] [Abstract][Full Text] [Related]  

  • 35. A multipolar approach to the interatomic covalent interaction energy.
    Francisco E; Menéndez Crespo D; Costales A; Martín Pendás Á
    J Comput Chem; 2017 Apr; 38(11):816-829. PubMed ID: 28211059
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Halogen bonds and other noncovalent interactions in the crystal structures of trans-1,2-diiodo alkenes: an ab initio and QTAIM study.
    Yuan Y; Mills MJL; Li F; Du Y; Wei J; Su W
    J Mol Model; 2020 Nov; 26(11):331. PubMed ID: 33150494
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Hard Numbers for Large Molecules: Toward Exact Energetics for Supramolecular Systems.
    Ambrosetti A; Alfè D; DiStasio RA; Tkatchenko A
    J Phys Chem Lett; 2014 Mar; 5(5):849-55. PubMed ID: 26274077
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Nature and Strength of Weak O⋅⋅⋅O Interactions in Nitryl Halide Dimers.
    Petelski AN; Duarte DJR; Peruchena NM
    Chemphyschem; 2023 Apr; 24(7):e202200768. PubMed ID: 36515410
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Olefinic vs. aromatic pi-H interaction: a theoretical investigation of the nature of interaction of first-row hydrides with ethene and benzene.
    Tarakeshwar P; Choi HS; Kim KS
    J Am Chem Soc; 2001 Apr; 123(14):3323-31. PubMed ID: 11457068
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Co-operativity in non-covalent interactions in ternary complexes: a comprehensive electronic structure theory based investigation.
    Panneer SVK; Ravva MK; Mishra BK; Subramanian V; Sathyamurthy N
    J Mol Model; 2018 Aug; 24(9):258. PubMed ID: 30159795
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 8.