Pregled po CROSBI profilu: Mario Vazdar (CROSBI Profil: 23488, MBZ: 268682)
Pronađeno 119 radova
-
51.Jovanović, Olga; Pashkovskaya, Alina, A.; Annibal, Andrea; Vazdar, Mario; Burchardt, Nadine; Sansone, Anna; Gille, Lars; Fedorova, Maria; Ferreri, Carla; Pohl, Elena E.The molecular mechanism behind reactive aldehyde action on transmembrane translocations of proton and potassium ions // Free radical biology & medicine, 89 (2015), 1067-1076 doi:10.1016/j.freeradbiomed.2015.10.422 (međunarodna recenzija, članak, znanstveni)
-
52.Dražić, Tonko; Vazdar, Katarina; Vazdar, Mario; Đaković, Marijana; Mikecin, Ana-Matea; Kralj, Marijeta; Malnar, Martina; Hećimović, Silva; Habuš, IvanSynthesis of new 2-aminoimidazolones with antiproliferative activity via base promoted amino-β-lactam rearrangement // Tetrahedron, 71 (2015), 49; 9202-9215 doi:10.1016/j.tet.2015.10.048 (međunarodna recenzija, članak, znanstveni)
-
53.Kulig, W.; Olżyńska, A.; Jurkiewicz P.; Kantola, A. M.; Komulainen, S; Manna, M.; Pourmosa, M.; Vazdar, Mario; Cwiklik, L.; Rog, T. et al.Cholesterol under oxidative stress - how lipid membranes sense oxidation as cholesterol is being replaced by oxysterols // Free radical biology & medicine, 84 (2015), 30-41 doi:10.1016/j.freeradbiomed.2015.03.006 (međunarodna recenzija, članak, znanstveni)
-
54.Vazdar, Mario; Mitchell, Anthony, S.; Warrener, Ronald, N.; Margetić, DavorHigh pressure promoted exchange of guests from hemicarceplexes // Tetrahedron, 2015 (2015), 4; 550-553 doi:10.1016/j.tet.2014.12.040 (međunarodna recenzija, članak, znanstveni)
-
55.Vojta, Danijela; Kovačević, Goran; Vazdar, MarioThe exploration of hydrogen bonding properties of 2, 6- and 3, 5-diethynylpyridine by IR spectroscopy // Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 136C (2015), Part C; 1912-1923 doi:10.1016/j.saa.2014.10.107 (međunarodna recenzija, članak, znanstveni)
-
56.Gladich, Ivan; Francisco, Joseph; Buszek, Robert; Vazdar, Mario; Carignano, Marcelo; Shepson, PaulAb Initio Study of the Reaction of Ozone with Bromide Ion // Journal of physical chemistry A, 119 (2015), 19; 4482-4488 doi:10.1021/jp5101279 (međunarodna recenzija, članak, znanstveni)
-
57.Margetić, Davor; Vazdar, MarioMirjana Eckert-Malsić – Biography and Contributions // Croatica chemica acta, 87 (2014), 4; CCCCXIX-CCCCXXII (podatak o recenziji nije dostupan, zivotopis, ostalo)
-
58.Margetić, Davor; Vazdar, MarioEditorial // Croatica chemica acta, 87 (2014), 4; CCCCXVII-CCCCXVII (podatak o recenziji nije dostupan, uvodnik, stručni)
-
59.Pokorna, Sarka; Jurkiewicz, Piotr; Vazdar, Mario; Cwiklik, Lukasz; Jungwirth, Pavel; Hof, MartinDoes fluoride disrupt hydrogen bond network in cationic lipid bilayer? Time-dependent fluorescence shift of Laurdan and MD simulations // The Journal of chemical physics, 141 (2014), 22; 22D516, 10 doi:10.1063/1.4898798 (međunarodna recenzija, članak, znanstveni)
-
60.Vojta, Danijela; Vazdar, MarioThe study of hydrogen bonding and pi...pi interactions in phenol...ethynylbenzene complex by IR spectroscopy // Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 132 (2014), 1/2; 6-14 doi:10.1016/j.saa.2014.04.149 (međunarodna recenzija, članak, znanstveni)
-
61.Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, MarioAcetamide as the Model of the Peptide Bond: Nonadiabatic Photodynamical Simulations in the Gas Phase and in the Argon Matrix // Computational and theoretical chemistry, 1040/1041 (2014), 136-143 doi:10.1016/j.comptc.2014.02.025 (međunarodna recenzija, članak, znanstveni)
-
62.Timr, Stepan; Bondar, Alexey; Cwiklik, Lukasz; Stefl, Martin; Hof, Martin; Vazdar, Mario; Lazar, Josef; Jungwirth, PavelAccurate Determination of the Orientational Distribution of a Fluorescent Molecule in a Phospholipid Membrane // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 118 (2014), 4; 855-863 doi:10.1021/jp4067026 (međunarodna recenzija, članak, znanstveni)
-
63.Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, MarioComputational study of acetamide photodissociation // 18th European Symposium on Organic Chemistry / Rodriguez, Jean-Antoine (ur.).
Marseille: Aix Marseille University, 2013. (poster, međunarodna recenzija, sažetak, znanstveni) -
64.Vazdar, Mario; Wernersson, Erik; Khabiri, Morteza; Cwiklik, Lukasz; Jurkiewicz, Piotr; Hof, Martin; Mann, Ella; Kolusheva, Sofiya; Jelinek, Raz; Jungwirth, PavelAggregation of Oligoarginines at Phospholipid Membranes: Molecular Dynamics Simulations, Time- Dependent Fluorescence Shift, and Biomimetic Colorimetric Assays // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 117 (2013), 39; 11530-11540 doi:10.1021/jp405451e (međunarodna recenzija, članak, znanstveni)
-
65.Vazdar, Mario; Jungwirth, Pavel; Mason, PhilipAqueous Guanidinium-Carbonate Interactions by Molecular Dynamics and Neutron Scattering: Relevance to Ion-Protein Interactions // The journal of physical chemistry. B, 117 (2013), 6; 1844-1848 doi:10.1021/jp310719g (međunarodna recenzija, članak, znanstveni)
-
66.Pokorna, Sarka; Jurkiewicz, Piotr; Cwiklik, Lukasz; Vazdar, Mario; Hof, MartinInteractions of monovalent salts with cationic lipid bilayers // Faraday discussions, 160 (2013), 341-358 doi:10.1039/c2fd20098h (međunarodna recenzija, članak, znanstveni)
-
67.Antol, Ivana; Eckert-Maksić, Mirjana; Vazdar, Mario; Ruckenbauer, Matthias; Lischka, HansQM/MM nonadiabatic decay dynamics of formamide in polar and nonpolar solvents // Physical Chemistry Chemical Physics, 14 (2012), 38; 13262-13272 doi:10.1039/C2CP41830D (međunarodna recenzija, članak, znanstveni)
-
68.Vazdar, Mario; Pluharova, Eva; Mason, Philip; Vacha, Robert; Jungwirth, PavelIons at Hydrophobic Aqueous Interfaces: Molecular Dynamics with Effective Polarization // Journal of Physical Chemistry Letters, 3 (2012), 15; 2087-2091 doi:10.1021/jz300805b (međunarodna recenzija, članak, znanstveni)
-
69.Vazdar, Mario; Uhlig, Frank; Jungwirth, PavelLike-charge Ion Pairing in Water: An ab initio Molecular Dynamics Study of Aqueous Guanidinium Cations // Journal of Physical Chemistry Letters, 3 (2012), 15; 2021-2024 doi:10.1021/jz3007657 (međunarodna recenzija, članak, znanstveni)
-
70.Vazdar, Mario; Jurkiewicz, Piotr; Hof, Martin; Jungwirth, Pavel; Cwiklik, LukaszBehavior of 4-Hydroxynonenal in Phospholipid Membranes // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 116 (2012), 22; 6411-6415 doi:10.1021/jp3044219 (međunarodna recenzija, članak, znanstveni)
-
71.Kubickova, Anna; Krizek, Tomas; Coufal, Pavel; Vazdar, Mario; Wernersson, Erik; Heyda, Jan; Jungwirth, PavelOvercharging in biological systems: Reversal of electrophoretic mobility of aqueous polyaspartate by multivalent cations // Physical Review Letters, 108 (2012), 18; 186101-1 doi:10.1103/PhysRevLett.108.186101 (međunarodna recenzija, članak, znanstveni)
-
72.Barbatti, Mario; Ruckenbauer, Matthias; Szymczak, Jaroslaw, J.; Sellner, Bernhard; Vazdar, Mario; Antol, Ivana; Eckert-Maksić, Mirjana; Lischka, HansModel systems for dynamics of pi-conjugated biomolecules in excited states // Handbook of Computational Chemistry / Leszczynski, Jerzy (ur.).
Berlin : Heidelberg: Springer, 2012. str. 1175-1213 -
73.Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario; Ruckenbauer, Mattias; Lischka, HansEffect of environment on the nonadiabatic excited-state dynamics of formamide // The 13th European Symposium on Organic Reactivity - Book of Abstracts / Burk, Peeter (ur.).
Tartu: University of Tartu, Institute of Chemistry, 2011. (predavanje, međunarodna recenzija, sažetak, znanstveni) -
74.Cwiklik, Lukasz; Aquino, Adelia; Vazdar, Mario; Jurkiewicz, Piotr; Pittner, Jiri; Hof, Martin; Lischka, HansAbsorption and Fluorescence of PRODAN in Phospholipid Bilayers: A Combined Quantum Mechanics and Classical Molecular Dynamics Study // Journal of Physical Chemistry. A, 115 (2011), 41 (S.I.); 11428-11437 doi:: 10.1021/jp205966b (međunarodna recenzija, članak, znanstveni)
-
75.Wernersson, Erik; Heyda, Jan; Vazdar, Mario; Lund, Mikael; Mason, Philip; Jungwirth, PavelOrientational Dependence of the Affinity of Guanidinium Ions to the Water Surface // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 115 (2011), 43; 12521-12526 doi:10.1021/jp207499s (međunarodna recenzija, članak, znanstveni)
-
76.Faraji, Shirin; Vazdar, Mario; Reddy, Sivaranjana V.; Eckert- Maksić, Mirjana; Lischka, Hans; Koeppel, HorstAb initio quantum dynamical study of the multi-state nonadiabatic photodissociation of pyrrole // The Journal of chemical physics, 135 (2011), 15; 154310, 13 doi:10.1063/1.3651536 (međunarodna recenzija, članak, znanstveni)
-
77.Vazdar, Mario; Vymetal, Jiri; Heyda, Jan; Vondrasek, Jiri; Jungwirth, PavelLike-Charge Guanidinium Pairing from Molecular Dynamics and Ab Initio Calculations // Journal of Physical Chemistry. A, 115 (2011), 41; 11193-11201 doi:10.1021/jp203519p (međunarodna recenzija, članak, znanstveni)
-
78.Škorić, Irena; Pavošević, Fabijan; Vazdar, Mario; Marinić, Željko; Šindler-Kulyk, Marija; Eckert-Maksić, Mirjana; Margetić, DavorThermal reaction of [3,4]-benzo-8-substituted-3Z,5Z,7E-octatetraenes and quantum-chemical study of the (8π,6π)-electrocyclisation // Organic & biomolecular chemistry, 9 (2011), 19; 6771-6778 doi:10.1039/c1ob05802a (međunarodna recenzija, članak, znanstveni)
-
79.Eckert-Maksić, Mirjana; Vazdar, Mario; Ruckenbauer, Matthias; Barbatti, Mario; Müller, Thomas; Lischka, HansMatrix-Controlled Photofragmentation of Formamide: Dynamics Simulation in Argon by Nonadiabatic QM/MM Method // Physical Chemistry Chemical Physics, 12 (2010), 39; 12719-12726 doi:10.1039/C0CP00174K (međunarodna recenzija, članak, znanstveni)
-
80.Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Lischka, HansFormamide as the Model Compound for Photodissociation Studies of the Peptide Bond, Kinetics and Dynamics // Kinetics and Dynamics: From Nano- to Bio-Scale / Paneth, P. ; Dybala-Defratyka, A. (ur.)., 2010. str. 77-107 doi:10.1007/978-90-481-3034-4_3
-
81.Glasovac, Zoran; Antol, Ivana; Vazdar, Mario; Margetić, DavorZwitterionic structures of strained cis-pyramidalised disilenes – Fact or artifact // Theoretical chemistry accounts, 124 (2009), 5-6; 421-430 doi:10.1007/s00214-009-0633-x (međunarodna recenzija, članak, znanstveni)
-
82.Eckert-Maksić, Mirjana; Lischka, Hans; Maksić, Zvonimir B.; Vazdar, MarioThe Isomerization Barrier in Cyanocyclobutadienes: An ab Initio Multireference Average Quadratic Coupled Cluster Study // Journal of Physical Chemistry A, 113 (2009), 29; 8351-8358 doi:10.1021/jp9015273 (međunarodna recenzija, članak, znanstveni)
-
83.Pavošević, Fabijan; Škorić, Irena; Margetić, Davor; Vazdar, Mario; Marinić, Željko; Eckert- Maksić, Mirjana; Šindler-Kulyk, MarijaTermičke (8pi, 6pi)-elektrociklizacije novih oktatetraenskih derivata : sinteza i kvantno kemijski računi // XXI. hrvatski skup kemičara i kemijskih inženjera : knjiga sažetaka = book of abstracts / Pičuljan, Katarina ; Smolec, S0nja (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI), 2009. str. 107-107 (poster, sažetak, znanstveni) -
84.Vazdar, Mario; Eckert-Maksić, Mirjana; Barbatti, Mario; Lischka, HansTheoretical investigation of the nonadiabatic deactivation of pyrrole // XXI. Hrvatski skup kemičara i kemijskih inženjera – Knjiga sažetaka / Novak, Predrag ; Pičuljan, Katarina ; Smolec, Sonja (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI), 2009. str. 182-182 (poster, sažetak, znanstveni) -
85.Vazdar, Mario; Eckert-Maksić, Mirjana; Barbatti, Mario; Lischka, HansExcited-state non-adiabatic dynamics simulations of pyrrole // Molecular physics, 107 (2009), 8-12; 845-854 doi:10.1080/00268970802665639 (međunarodna recenzija, članak, znanstveni)
-
86.Glasovac, Zoran; Vazdar, Mario; Margetić, DavorProton affinities of didehydroporphyrin and subporphyrin in ground and excited states obtained by quantum chemical calculations // Croatica Chemica Acta, 82 (2009), 1; 63-70 (međunarodna recenzija, članak, znanstveni)
-
87.Vazdar, MarioAb initio studij istezne izomerizacije ciklobutadiena i njegovih derivata, 2008., doktorska disertacija, Prirodoslovno-matematički fakultet, Zagreb
-
88.Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Lischka, HansPhotochemistry of formamide and its protonated forms – An ab initio surface hopping dynamics simulations // 7th European Conference on Computational Chemistry : Book of abstracts / Polimeno, Antonino ; Casarin, Maurizio ; Olivucci, Massimo ; Laganá, Antonio (ur.).
Venecija: Universita degli studi di Padova, 2008. str. 105-106 (poster, međunarodna recenzija, sažetak, znanstveni) -
89.Vazdar, Mario; Eckert-Maksić, Mirjana; Barbatti, Mario Barbatti; Aquino, Adélia J. A. Aquino, Lischka, HansThe mechanism of the nonadiabatic deactivation of pyrrole // Abstracts of the Central European Symposium on Theoretical Chemistry 2008 : CESTC 2008 / Čarsky, Petr (ur.).
Prag, 2008. str. 50-51 (poster, sažetak, znanstveni) -
90.Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Lischka, HansDynamic simulations of photodissociations of formamide and its protonated form in the gas phase // Book of Abstracts of the 19th IUPAC Conference on Physical Organic Chemistry / Leis, José R. ; García-Río, Luís ; Santaballa, Arturo ; Canle, Moisés ; Mejuto, Juan C. (ur.).
Santiago de Compostela: The Royal University of Santiago de Compostela, 2008. str. 74-74 (predavanje, međunarodna recenzija, sažetak, znanstveni) -
91.Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Eckert-Maksić, MirjanaAn ab initio surface hopping dynamics study on the photodeactivation processes in protonated formamide // Electron correlation and molecular dynamics for excited states and photochemistry Symposium in honor of Hans Lischka´s 65th birthday : Book of Abstracts / Aquino, A. J. Adélia (ur.).
Beč: Erwin Schrödinger Institute (ESI), 2008. str. 34-34 (poster, međunarodna recenzija, sažetak, znanstveni) -
92.Vazdar, Mario; Barbatti, Mario; Aquino, Adélia J. A.; Eckert-Maksić, Mirjana; Lischka, HansThe nonadiabatic deactivation paths of pyrrole // Electron correlation and molecular dynamics for excited states and photochemistry Symposium in honor of Hans Lischka´s 65th birthday : Abstracts / Aquino, A. J. Adélia ; (ur.).
Beč: Erwin Schrödinger Institute (ESI), 2008. str. 35-35 (poster, međunarodna recenzija, sažetak, znanstveni) -
93.Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Eckert-Maksić, MirjanaThe effect of protonation on the photodissociation processes in formamide – an ab initio surface hopping dynamics study // Chemical physics, 349 (2008), 1-3; 308-318 doi:10.1016/j.chemphys.2008.01.026 (međunarodna recenzija, članak, znanstveni)
-
94.Vazdar, Mario; Eckert-Maksić, Mirjana; Lischka, Hans; Maksić, Zvonimir B.The Izomerization Barrier in Cyanocyclobutadienes - An ab initio MR-AQCC Study // Central European Symposium on Theoretical Chemistry 2007
Litschau, Austrija, 2007. str. 23-24 (predavanje, sažetak, znanstveni) -
95.Glasovac, Zoran; Vazdar, Mario; Eckert-Maksić, Mirjana; Margetić, DavorProton affinities of dehydroporphyrin and subporphyrin in ground and excited states obtained by high level computations // Abstracts of the eleventh electronic computational chemistry conference : ECCC-11 / Topper, Robert Q. ; Dmitrenko, Olga (ur.).
elektronska konferencija, 2007. (poster, međunarodna recenzija, sažetak, znanstveni) -
96.Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, MarioComparison of TD-DFT and MRCI calculated vertical excitation energies for formamide and its cationized forms // 12th International Conference on the Applications of Density Functional Method in Physics and Chemistry : Programme and Abstractbook / Baerends, Evert Jan (ur.).
Amsterdam: HRMC Congresorganisatie, 2007. str. 123-123 (poster, međunarodna recenzija, sažetak, znanstveni) -
97.Vazdar, Mario; Eckert-Maksić, Mirjana; Barbatti, Mario; Aquino, Adélia J. A.; Lischka, HansMehanizam neadijabatske deaktivacije pirola // XX. jubilarni hrvatski skup kemičara i kemijskih inženjera : Knjiga sažetaka / Vrsalović Presečki, Ana ; Findrik, Zvjezdana (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa, Hrvatsko kemijsko društvo, 2007. str. 160-160 (poster, domaća recenzija, sažetak, znanstveni) -
98.Barbatti, M.; Granucci, G.; Persico, M.; Ruckenbauer, M.; Vazdar, Mario; Eckert-Maksić, Mirjana; Lischka, H.The on-the-fly surface-hopping program system NEWTON-X: application to ab initio simulation of the nonadiabatic photodynamics of benchmark systems // Journal of Photochemistry and Photobiology A, 190 (2007), 2-3; 228-240 (međunarodna recenzija, članak, znanstveni)
-
99.Margetić, Davor; Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, MarioQuantum Chemical Study on the Effects of Incorporation of Silicon and Germanium Bridges on Pyramidalization of Olefinic Carbon Atoms in Sesquinorbornene Framework // Abstracts of the 12th International Congress of Quantum Chemistry
Kyoto, 2006. (poster, sažetak, znanstveni) -
100.Eckert-Maksić, Mirjana; Vazdar, Mario; Barbatti, Mario; Lischka, Hans; Maksić, Zvonimir B.Automerization of Cyclobutadiene and its Barrier Height-An Ab Initio Study // 3rd Meeting of the COST working group D26/0014/03 Intrinsic Reactivity of new Molecular Materials / Eckert-Maksić, Mirjana (ur.).
Zagreb: Institut Ruđer Bošković, 2006. (poster, sažetak, znanstveni)
