Thermal and Mechanochemical Tuning of the Porphyrin Singlet-Triplet Gap for Selective Energy Transfer Processes: A Molecular Dynamics Approach von Zapata, Felipe, Nucci, Martina, Castaño, Obis, Marazzi, Marco, Frutos, Luis Manuel

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[10]annulene: Electrocyclization mechanisms von Palmeiro, Raúl, Castaño, Obis

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Synthesis, Optical Properties, and Regioselective Functionalization of 4a-Aza-10a-boraphenanthrene von Abengózar, Alberto, García-García, Patricia, Sucunza, David, Frutos, Luis Manuel, Castaño, Obis, Sampedro, Diego, Pérez-Redondo, Adrián, Vaquero, Juan J

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How mechanical forces can modulate the metal affinity and selectivity of metal binding sites in proteins von Dudev, Todor, Frutos, Luis Manuel, Castaño, Obis

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Definition and determination of the triplet-triplet energy transfer reaction coordinate von Zapata, Felipe, Marazzi, Marco, Castaño, Obis, Acuña, A Ulises, Frutos, Luis Manuel

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Halogen-containing thiazole orange analogues - new fluorogenic DNA stains von Vasilev, Aleksey A, Kandinska, Meglena I, Stoyanov, Stanimir S, Yordanova, Stanislava B, Sucunza, David, Vaquero, Juan J, Castaño, Obis D, Baluschev, Stanislav, Angelova, Silvia E

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Cubane, Cuneane, and Their Carboxylates:  A Calorimetric, Crystallographic, Calculational, and Conceptual Coinvestigation von Roux, Maria Victoria, Dávalos, Juan Z, Jiménez, Pilar, Notario, Rafael, Castaño, Obis, Chickos, James S, Hanshaw, William, Zhao, Hui, Rath, Nigam, Liebman, Joel F, Farivar, Behzad S, Bashir-Hashemi, A

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Modulating Nitric Oxide Release by S-Nitrosothiol Photocleavage: Mechanism and Substituent Effects von Marazzi, Marco, López-Delgado, Alberto, Fernández-González, Miguel Angel, Castaño, Obis, Frutos, Luis Manuel, Temprado, Manuel

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Photoinduced Proton Transfer as a Possible Mechanism for Highly Efficient Excited-State Deactivation in Proteins von Marazzi, Marco, Sancho, Unai, Castaño, Obis, Domcke, Wolfgang, Frutos, Luis Manuel

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Azonia aromatic heterocycles as a new acceptor unit in D-π-A+vs D-A+ nonlinear optical chromophores von Cañeque, Tatiana, Cuadro, Ana M., Custodio, Raúl, Alvarez-Builla, Julio, Batanero, Belén, Gómez-Sal, Pilar, Pérez-Moreno, Javier, Clays, Koen, Castaño, Obis, Andrés, José L., Carmona, Thais, Mendicuti, Francisco, Vaquero, Juan J.

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Novel charged NLO chromophores based on quinolizinium acceptor units von Cañeque, Tatiana, Cuadro, Ana M., Alvarez-Builla, Julio, Pérez-Moreno, Javier, Clays, Koen, Castaño, Obis, Andrés, José L., Vaquero, Juan J.

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Design and photophysical properties of a new molecule with a N–B–N linked chromophore von Bakalova, Snezhana, Mendicuti, Francisco, Castaño, Obis, Kaneti, Jose

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Rearrangement of Dewar Benzene Derivatives Studied by DFT von Dračínský, Martin, Castaño, Obis, Kotora, Martin, Bouř, Petr

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Highly efficient unbridged D-A plus (D) chromophores based on the quinolizinium cation for nonlinear optical (NLO) applications von Sanchez-Pavon, Esmeralda, Recio, Javier, Ramirez, Marco Antonio, Batanero, Belen, Clays, Koen, Mendicuti, Francisco, Marcelo, Gema, Carmona, Thais, Castano, Obis, Angelova, Silvia, Andres, Jose L, Vaquero, Juan J, Cuadro, Ana M

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First principles study of photostability within hydrogen-bonded amino acids von MARAZZI, Marco, SANCHO, Unai, CASTANO, Obis, FRUTOS, Luis Manuel

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Structural Substituent Effect in the Excitation Energy of a Chromophore: Quantitative Determination and Application to S‑Nitrosothiols von Fernández-González, Miguel Ángel, Marazzi, Marco, López-Delgado, Alberto, Zapata, Felipe, García-Iriepa, Cristina, Rivero, Daniel, Castaño, Obis, Temprado, Manuel, Frutos, Luis Manuel

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Trapping Unstable Terminal M−O Multiple Bonds of Monocyclopentadienyl Niobium and Tantalum Complexes with Lewis Acids von Sánchez-Nieves, Javier, Frutos, Luis M, Royo, Pascual, Castaño, Obis, Herdtweck, Eberhardt, Mosquera, Marta E. G

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Donor-(π-bridge)-azinium as D-π-A+ one-dimensional and D-π-A(+)-π-D multidimensional V-shaped chromophores von Ramírez, Marco Antonio, Cuadro, Ana M, Alvarez-Builla, Julio, Castaño, Obis, Andrés, Jose L, Mendicuti, Francisco, Clays, Koen, Asselberghs, Inge, Vaquero, Juan J

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A new algorithm for predicting triplet-triplet energy-transfer activated complex coordinate in terms of accurate potential-energy surfaces von Frutos, Luis Manuel, Castaño, Obis

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Synthesis of charged bis-heteroaryl donor-acceptor (D-A+) NLO-phores coupling (π-deficient-π-excessive) heteroaromatic rings von Ramirez, Marco Antonio, Custodio, Raul, Cuadro, Ana M, Alvarez-Builla, Julio, Clays, Koen, Asselberghs, Inge, Mendicuti, Francisco, Castaño, Obis, Andrés, José L, Vaquero, Juan J

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