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 *

212 related articles for article (PubMed ID: 30896947)

  • 21. Long-range correction for tight-binding TD-DFT.
    Humeniuk A; Mitrić R
    J Chem Phys; 2015 Oct; 143(13):134120. PubMed ID: 26450305
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Photoinduced degradation of indigo carmine: insights from a computational investigation.
    Filho AHDS; Candeias FS; da Silva SC; Vicentini FC; Assumpção MHMT; Brown A; de Souza GLC
    J Mol Model; 2020 Oct; 26(11):309. PubMed ID: 33084954
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Computational prediction of absorbance maxima for a structurally diverse series of engineered green fluorescent protein chromophores.
    Timerghazin QK; Carlson HJ; Liang C; Campbell RE; Brown A
    J Phys Chem B; 2008 Feb; 112(8):2533-41. PubMed ID: 18247600
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Non-Degenerate Two-Photon Absorption of Fluorescent Protein Chromophores.
    Elayan IA; Brown A
    J Phys Chem A; 2024 Sep; 128(36):7511-7523. PubMed ID: 39192559
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Nonadiabatic Dynamics of Cycloparaphenylenes with TD-DFTB Surface Hopping.
    Stojanović L; Aziz SG; Hilal RH; Plasser F; Niehaus TA; Barbatti M
    J Chem Theory Comput; 2017 Dec; 13(12):5846-5860. PubMed ID: 29140693
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Excitations, optical absorption spectra, and optical excitonic gaps of heterofullerenes. I. C60, C59N+, and C48N12: theory and experiment.
    Xie RH; Bryant GW; Sun G; Nicklaus MC; Heringer D; Frauenheim T; Manaa MR; Smith VH; Araki Y; Ito O
    J Chem Phys; 2004 Mar; 120(11):5133-47. PubMed ID: 15267383
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Tight-binding approximations to time-dependent density functional theory - A fast approach for the calculation of electronically excited states.
    Rüger R; van Lenthe E; Heine T; Visscher L
    J Chem Phys; 2016 May; 144(18):184103. PubMed ID: 27179467
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Benzothiazole-based fluorophores of donor-pi-acceptor-pi-donor type displaying high two-photon absorption.
    Hrobáriková V; Hrobárik P; Gajdos P; Fitilis I; Fakis M; Persephonis P; Zahradník P
    J Org Chem; 2010 May; 75(9):3053-68. PubMed ID: 20359209
    [TBL] [Abstract][Full Text] [Related]  

  • 29. DFTB/PCM Applied to Ground and Excited State Potential Energy Surfaces.
    Nishimoto Y
    J Phys Chem A; 2016 Feb; 120(5):771-84. PubMed ID: 26761635
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Tuning Two-Photon Absorption in Rhodopsin Chromophore via Backbone Modification: The Story Told by CC2 and TD-DFT.
    Sirimatayanant S; Andruniów T
    J Chem Theory Comput; 2024 Sep; 20(18):8118-26. PubMed ID: 39269133
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Excited-state calculations with TD-DFT: from benchmarks to simulations in complex environments.
    Jacquemin D; Mennucci B; Adamo C
    Phys Chem Chem Phys; 2011 Oct; 13(38):16987-98. PubMed ID: 21881657
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Excess and excited-state dipole moments of real-life dyes: a comparison between wave-function, BSE/
    Knysh I; Villalobos-Castro JDJ; Duchemin I; Blase X; Jacquemin D
    Phys Chem Chem Phys; 2023 Nov; 25(43):29993-30004. PubMed ID: 37905396
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Progress in time-dependent density-functional theory.
    Casida ME; Huix-Rotllant M
    Annu Rev Phys Chem; 2012; 63():287-323. PubMed ID: 22242728
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Conformational effects on the lowest excited states of benzoyl-pyrrolopyridazine: insights from PCM time-dependent DFT.
    Maftei D; Zbancioc G; Humelnicu I; Mangalagiu I
    J Phys Chem A; 2013 Apr; 117(15):3165-75. PubMed ID: 23527600
    [TBL] [Abstract][Full Text] [Related]  

  • 35. The eXact integral simplified time-dependent density functional theory (XsTD-DFT).
    de Wergifosse M; Grimme S
    J Chem Phys; 2024 May; 160(20):. PubMed ID: 38805556
    [TBL] [Abstract][Full Text] [Related]  

  • 36. TD-DFT and TD-DFTB Investigation of the Optical Properties and Electronic Structure of Silver Nanorods and Nanorod Dimers.
    Alkan F; Aikens CM
    J Phys Chem C Nanomater Interfaces; 2018 Oct; 122(41):23639-23650. PubMed ID: 30364415
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Linear and Nonlinear Optical Response in Silver Nanoclusters: Insight from a Computational Investigation.
    Day PN; Pachter R; Nguyen KA; Bigioni TP
    J Phys Chem A; 2016 Feb; 120(4):507-18. PubMed ID: 26730764
    [TBL] [Abstract][Full Text] [Related]  

  • 38. UV excitations of halons.
    Stojanović L; Alyoubi AO; Aziz SG; Hilal RH; Barbatti M
    J Chem Phys; 2016 Nov; 145(18):184306. PubMed ID: 27846696
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Two-photon excitation of substituted enediynes.
    Kauffman JF; Turner JM; Alabugin IV; Breiner B; Kovalenko SV; Badaeva EA; Masunov A; Tretiak S
    J Phys Chem A; 2006 Jan; 110(1):241-51. PubMed ID: 16392861
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Quantum chemistry behind bioimaging: insights from ab initio studies of fluorescent proteins and their chromophores.
    Bravaya KB; Grigorenko BL; Nemukhin AV; Krylov AI
    Acc Chem Res; 2012 Feb; 45(2):265-75. PubMed ID: 21882809
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 11.