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doc icon DUGiDocs 2014 The role of aromaticity in determining the molecular structure and reactivity of (endohedral metallo)fullerenes Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Luis Luis, Josep Maria ; Swart, Marcel ; Solà i Puig, Miquel
out url icon Recercat The Role of Aromaticity, Hybridization, Electrostatics, and Covalency in Resonance-Assisted Hydrogen Bonds of Adenine–Thymine (AT) Base Pairs and Their Mimics Guillaumes Domènech, Laia ; Simon i Rabasseda, Sílvia ; Fonseca Guerra, Célia
out url icon Recercat The Role of Aromaticity, Hybridization, Electrostatics, and Covalency in Resonance-Assisted Hydrogen Bonds of Adenine–Thymine (AT) Base Pairs and Their Mimics Guillaumes Domènech, Laia ; Simon i Rabasseda, Sílvia ; Fonseca Guerra, Célia
out url icon Recercat 1 juny 2018 The Role of Aromaticity, Hybridization, Electrostatics, and Covalency in Resonance-Assisted Hydrogen Bonds of Adenine–Thymine (AT) Base Pairs and Their Mimics
out url icon Recercat 5 juny 2018 The Role of Aromaticity, Hybridization, Electrostatics, and Covalency in Resonance-Assisted Hydrogen Bonds of Adenine–Thymine (AT) Base Pairs and Their Mimics Guillaumes Domènech, Laia ; Simon i Rabasseda, Sílvia ; Fonseca Guerra, Célia
doc icon DUGiDocs juny 2015 The Role of Aromaticity, Hybridization, Electrostatics, and Covalency in Resonance-Assisted Hydrogen Bonds of Adenine–Thymine (AT) Base Pairs and Their Mimics Guillaumes Domènech, Laia ; Simon i Rabasseda, Sílvia ; Fonseca Guerra, Célia
out url icon Recercat 15 febrer 2020 The Role of Aromaticity, Hybridization, Electrostatics, and Covalency in Resonance-Assisted Hydrogen Bonds of Adenine–Thymine (AT) Base Pairs and Their Mimics Guillaumes Domènech, Laia ; Simon i Rabasseda, Sílvia ; Fonseca Guerra, Célia
out url icon Recercat The role of the long-range exchange corrections in the description of electron delocalization in aromatic species Szczepanik, Dariusz W. ; Solà i Puig, Miquel ; Andrzejak, Marcin ; Pawełek, Barbara ; Dominikowska, Justyna ; Kukułka, Mercedes ; Dyduch, Karol ; Krygowski, Tadeusz M. ; Szatylowicz, Halina
out url icon Recercat The role of the long-range exchange corrections in the description of electron delocalization in aromatic species Szczepanik, Dariusz W. ; Solà i Puig, Miquel ; Andrzejak, Marcin ; Pawełek, Barbara ; Dominikowska, Justyna ; Kukułka, Mercedes ; Dyduch, Karol ; Krygowski, Tadeusz M. ; Szatylowicz, Halina
out url icon Recercat The role of the long-range exchange corrections in the description of electron delocalization in aromatic species Szczepanik, Dariusz W. ; Solà i Puig, Miquel ; Andrzejak, Marcin ; Pawełek, Barbara ; Dominikowska, Justyna ; Kukułka, Mercedes ; Dyduch, Karol ; Krygowski, Tadeusz M. ; Szatylowicz, Halina
out url icon Recercat 1 juny 2018 The role of the long-range exchange corrections in the description of electron delocalization in aromatic species
out url icon Recercat 5 juny 2018 The role of the long-range exchange corrections in the description of electron delocalization in aromatic species Szczepanik, Dariusz W. ; Solà i Puig, Miquel ; Andrzejak, Marcin ; Pawełek, Barbara ; Dominikowska, Justyna ; Kukułka, Mercedes ; Dyduch, Karol ; Krygowski, Tadeusz M. ; Szatylowicz, Halina
out url icon Recercat 15 febrer 2020 The role of the long-range exchange corrections in the description of electron delocalization in aromatic species Szczepanik, Dariusz W. ; Solà i Puig, Miquel ; Andrzejak, Marcin ; Pawełek, Barbara ; Dominikowska, Justyna ; Kukułka, Mercedes ; Dyduch, Karol ; Krygowski, Tadeusz M. ; Szatylowicz, Halina
doc icon DUGiDocs The role of the long-range exchange corrections in the description of electron delocalization in aromatic species Szczepanik, Dariusz W. ; Solà i Puig, Miquel ; Andrzejak, Marcin ; Pawełek, Barbara ; Dominikowska, Justyna ; Kukułka, Mercedes ; Dyduch, Karol ; Krygowski, Tadeusz M. ; Szatylowicz, Halina
out url icon Recercat Role of spin state and ligand charge in coordination patterns in complexes of 2,6-diacetylpyridinebis(semioxamazide) with 3d-block metal ions: A density functional theory study Stepanović, Stepan ; Andjelković, Ljubica ; Zlatar, Matija ; Andjelković, Katarina ; Gruden-Pavlović, Maja ; Swart, Marcel
doc icon DUGiDocs 2013 Role of spin state and ligand charge in coordination patterns in complexes of 2,6-diacetylpyridinebis(semioxamazide) with 3d-block metal ions: A density functional theory study Stepanović, Stepan ; Andjelković, Ljubica ; Zlatar, Matija ; Andjelković, Katarina ; Gruden-Pavlović, Maja ; Swart, Marcel
out url icon Recercat The role of spin states in the catalytic mechanism of the intra- and extradiol cleavage of catechols by O2 Stepanović, Stepan ; Angelone, Davide ; Gruden-Pavlović, Maja ; Swart, Marcel
out url icon Recercat 1 juny 2018 The role of spin states in the catalytic mechanism of the intra- and extradiol cleavage of catechols by O2
out url icon Recercat 5 juny 2018 The role of spin states in the catalytic mechanism of the intra- and extradiol cleavage of catechols by O2 Stepanović, Stepan ; Angelone, Davide ; Gruden-Pavlović, Maja ; Swart, Marcel
doc icon DUGiDocs 1 gener 2017 The role of spin states in the catalytic mechanism of the intra- and extradiol cleavage of catechols by O2 Stepanović, Stepan ; Angelone, Davide ; Gruden-Pavlović, Maja ; Swart, Marcel
out url icon Recercat SambVca 2. A Web Tool for Analyzing Catalytic Pockets with Topographic Steric Maps Falivene, Laura ; Credendino, Raffaele ; Poater Teixidor, Albert ; Petta, Andrea ; Serra, Luigi ; Oliva, Romina ; Scarano, Vittorio ; Cavallo, Luigi
out url icon Recercat SambVca 2. A Web Tool for Analyzing Catalytic Pockets with Topographic Steric Maps Falivene, Laura ; Credendino, Raffaele ; Poater Teixidor, Albert ; Petta, Andrea ; Serra, Luigi ; Oliva, Romina ; Scarano, Vittorio ; Cavallo, Luigi
out url icon Recercat 1 juny 2018 SambVca 2. A Web Tool for Analyzing Catalytic Pockets with Topographic Steric Maps
out url icon Recercat 5 juny 2018 SambVca 2. A Web Tool for Analyzing Catalytic Pockets with Topographic Steric Maps Falivene, Laura ; Credendino, Raffaele ; Poater Teixidor, Albert ; Petta, Andrea ; Serra, Luigi ; Oliva, Romina ; Scarano, Vittorio ; Cavallo, Luigi
doc icon DUGiDocs 2016 SambVca 2. A Web Tool for Analyzing Catalytic Pockets with Topographic Steric Maps Falivene, Laura ; Credendino, Raffaele ; Poater Teixidor, Albert ; Petta, Andrea ; Serra, Luigi ; Oliva, Romina ; Scarano, Vittorio ; Cavallo, Luigi
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