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Scientific papers

Last 5 years

  1. Macernis M, On the Dimers Stability of Allicin and Its Derivatives Interacting with AT, GC, and DNA Bridge: DFT Study, J. Chem., 2017, 1428508-11
  2. Macernis M, Nonlinear correlations Between ν1 Raman Band and Global Scalar Properties for Different Length Carotenoids, Lith. J. Phys., 2018 (accepted 2018-05-30)

Grpahical List

Macernis M, Nonlinear correlations Between ν1 Raman Band and Global Scalar Properties for Different Length Carotenoids, Lith. J. Phys., 2018 (accepted 2018-05-30)

10

Macernis M, On the Dimers Stability of Allicin and Its Derivatives Interacting with AT, GC, and DNA Bridge: DFT Study, J. Chem., 2017, 1428508-11

9

Macernis M; Galzerano D; Sulskus J; Kish E; Kim YH; Koo S; Valkunas L; Robert B, Resonance Raman Spectra of Carotenoid Molecules: Influence of Methyl Substitutions, J. Phys. Chem. A, 2015, 119 (1), 56–66

8

Macernis M; Sulskus J; Malickaja S Ruban A; Valkunas L, Resonance Raman Spectra and Electronic Transitions in Carotenoids: A Density Functional Theory Study, J. Phys. Chem. A, 2014, 118 (10), 1817–1825

7

Toliautas S.; Macernis M; Sulskus J.; Valkunas L, Solvent effect on the photo-induced proton transfer in 2-(N-methyl-α-iminoethyl)-phenol, Chem Phys Lett 2014, (591), 52-57

6

Duffy C; Chmeliov J; Macernis M; Sulskus J; Valkunas L; Ruban A, Modeling of Fluorescence Quenching by Lutein in the Plant Light-Harvesting Complex LHCII, J Phys Chem B 2013, (117), 10974–10986

5

Macernis M; Sulskus J; Duffy C; Ruban A; Valkunas L, The Electronic Spectra of Structurally Deformed Lutein, J Phys Chem A 2012, 116 (40), 9843–9853

4

Karpicz R; Gulbinas V; Lewanowicz A, Macernis M, Sulskus J, Valkunas L, Relaxation Pathways of Excited N-(Triphenylmethyl)salicylidenimine in Solutions, J. Phys. Chem. A, 2011, 115(19), 1861-1868

5

Jasinskas R; Maršalka A; Šulskus J; Macernis M; Augulienė V; Kazlauskas M; Lunytė E, Materiologinių sąlygų modeliavimas naujos kartos HARMONIE modeliu, vartinant radioaktyvių medžiagų sklaidą avarijų metu. Visuomenės sveikata (Public Health) 2012, 2, 31–35

2

Duffy CDP; Johnson MP; Macernis M; Valkunas L; Barford W; Ruban AV, A theoretical investigation of the photophysical consequences of major plant light-harvesting complex aggregation within the photosynthetic membrane, J. Phys. Chem. B, 2010, 114 (46), 15244-15253

3

Kietis BP; Macernis M; Sulskus J; Valkunas L, Estimation of the permanent dipole moment of bacteriorhodopsin, Lith. J. Phys., 2010, 114 (46), 15244-15253

1

Macernis M; Kietis BP; Sulskus J; Lin SH; Hayashi M; Valkunas L, Triggering the proton transfer by H-bond network, Chem. Phys. Lett., 2008, 466 (4-6), 223-226

All time

  1. Macernis M; Kietis BP; Sulskus J; Lin SH; Hayashi M; Valkunas L, Triggering the proton transfer by H-bond network, Chem. Phys. Lett., 2008, 466 (4-6), 223-226
  2. Kietis BP; Macernis M; Sulskus J; Valkunas L, Estimation of the permanent dipole moment of bacteriorhodopsin, Lith. J. Phys., 2010, 114 (46), 15244-15253
  3. Duffy CDP; Johnson MP; Macernis M; Valkunas L; Barford W; Ruban AV, A theoretical investigation of the photophysical consequences of major plant light-harvesting complex aggregation within the photosynthetic membrane, J. Phys. Chem. B, 2010, 114 (46), 15244-15253
  4. Jasinskas R; Maršalka A; Šulskus J; Macernis M; Augulienė V; Kazlauskas M; Lunytė E,Materiologinių sąlygų modeliavimas naujos kartos HARMONIE modeliu, vartinant radioaktyvių medžiagų sklaidą avarijų metu., Visuomenės sveikata (Public Health) 2012, 2, 31–35
  5. Karpicz R; Gulbinas V; Lewanowicz A, Macernis M, Sulskus J, Valkunas L, Relaxation Pathways of Excited N-(Triphenylmethyl)salicylidenimine in Solutions, J. Phys. Chem. A, 2011, 115(19), 1861-1868
  6. Macernis M; Sulskus J; Duffy C; Ruban A; Valkunas L, The Electronic Spectra of Structurally Deformed Lutein, J Phys Chem A 2012, 116 (40), 9843–9853
  7. Duffy C; Chmeliov J; Macernis M; Sulskus J; Valkunas L; Ruban A, Modeling of Fluorescence Quenching by Lutein in the Plant Light-Harvesting Complex LHCII, J Phys Chem B 2013, (117), 10974–10986
  8. Toliautas S.; Macernis M; Sulskus J.; Valkunas L, Solvent effect on the photo-induced proton transfer in 2-(N-methyl-α-iminoethyl)-phenol, Chem Phys Lett 2014, (591), 52-57
  9. Macernis M; Sulskus J; Malickaja S Ruban A; Valkunas L, Resonance Raman Spectra and Electronic Transitions in Carotenoids: A Density Functional Theory Study, J. Phys. Chem. A, 2014, 118 (10), 1817–1825
  10. Macernis M; Galzerano D; Sulskus J; Kish E; Kim YH; Koo S; Valkunas L; Robert B, Resonance Raman Spectra of Carotenoid Molecules: Influence of Methyl Substitutions, J. Phys. Chem. A, 2015, 119 (1), 56–66
  11. Macernis M, On the Dimers Stability of Allicin and Its Derivatives Interacting with AT, GC, and DNA Bridge: DFT Study, J. Chem., 2017, 1428508-11
  12. Macernis M, Nonlinear correlations Between ν1 Raman Band and Global Scalar Properties for Different Length Carotenoids, Lith. J. Phys., 2018 (accepted 2018-05-30)