UJI

Informació personal

OLIVA DOMÍNGUEZ, MÓNICA
  • Professor/a Titular d'Universitat
  • Vocal
  • Química Teòrica i Computacional
  • TC1223DD - (964 728088)
  • oliva@uji.es

  • Horari Actual


    Horari de tutories de Mónica Oliva Domínguez


    Primer semestre


    Dia Hora Inicial Hora Final Data Inicial Data Final
    Dimarts 10:00 13:00 10-09-2019 23-01-2020
    Dijous 10:00 13:00 10-09-2019 23-01-2020

    Segon semestre


    Dia Hora Inicial Hora Final Data Inicial Data Final
    Dimecres 10:00 13:00 24-01-2020 31-07-2020
    Dijous 10:00 13:00 24-01-2020 31-07-2020

    Horari de docència de Mónica Oliva Domínguez


    Primer semestre


    Assignatura Dia Hora Inicial Hora Final Data Inicial Data Final
    EQ1012 - LA1 Dijous 15:01 17:30 28-11-2019 12-12-2019
    EQ1012 - LA2 Dimarts 16:00 18:30 26-11-2019 10-12-2019
    EQ1012 - PR1 Dimecres 13:00 14:00 06-11-2019 11-12-2019
    EQ1012 - TE1 Dilluns 12:00 13:00 04-11-2019 16-12-2019
    EQ1012 - TE1 Dimecres 12:00 13:00 06-11-2019 18-12-2019
    EQ1012 - TE1 Divendres 11:00 12:00 08-11-2019 20-12-2019

    Segon semestre


    Assignatura Dia Hora Inicial Hora Final Data Inicial Data Final
    IN1107 - PR1 Dilluns 10:30 12:30 27-01-2020 17-02-2020
    IN1107 - PR1 Dimarts 10:30 12:30 28-01-2020 19-05-2020
    IN1107 - PR2 Dilluns 17:30 19:30 27-01-2020 17-02-2020
    IN1107 - PR2 Dimarts 15:00 17:00 10-03-2020 10-03-2020
    IN1107 - PR2 Dimarts 17:30 19:30 28-01-2020 19-05-2020

    Assignatures amb docència


    Assignatures Titulació
    EQ1012 - Ampliació de Química (Química) Grau en Enginyeria Química
    IN1107 - Farmacologia Bàsica i Administració de Medicaments Grau en Infermeria
    QU0943 - Trabajo de Final de Grado Grado en Química
    SIM014 - Cinètica Mèdica Màster Universitari en Química Aplicada i Farmacològica
    SIM037 - Pràctiques Externes Màster Universitari en Química Aplicada i Farmacològica

    Publicacions


    Publicacions periòdiques amb comitè de selecció


    Capítols de llibre


    • Hybrid QM/MM Studies on Chemical Reactivity
    • Raquel Castillo Solsona, Mónica Oliva Domínguez, Sergio Martí Forés, Vicente Moliner Ibáñez, I. Tuñón, Juan Manuel Andrés Bort. Recent Research Developments in Quantum Chemistry, Vol 3. India. Ed. Transworld Research Network. 2002. ISBN 817895043X. Científic.

    Ponències a congressos


    • Estudios teóricos de la reducción de nitrobenceno a anilina catalizada por clústeres Mo3S4 con ligandos difosfina y diamina
    • Vicente Sixto Safont Villarreal, Mónica Oliva Domínguez, Rosa María Llusar Barelles, Eva María Guillamón Torres, Juan Manuel Andrés Bort, Elena Pedrajas Gual, M.G. Basallote, A.G. Algarra. Workshop H2BioCatO2 2018. Castellón (Espanya). 25-10-2018. Científic. 2018.

    • Back to curly arrows notation: understanding chemical reactivity from the bonding evolution theory
    • Juan Manuel Andrés Bort, Patricio Andrés González Navarrete, Vicente Sixto Safont Villarreal, Mónica Oliva Domínguez, Bernard Silvi. 2nd European Symposium on Chemical Bonding (ESCB2). Oviedo (Espanya). 03-09-2018. Científic. 2018.

    • 1,3-dipolar cycloadditions between cyclic nitrones and ethyl acrylate. A bonding evolution theory study
    • Mónica Oliva Domínguez, Juan Manuel Andrés Bort, Vicente Sixto Safont Villarreal. 2nd European Symposium on Chemical Bonding (ESCB2). Oviedo (Espanya). 03-09-2018. Científic. 2018.

    • Cuboidal Mo3S4 Clusters as Molecular Analogs of MoS2 for the Catalytic Hydrogenation of Organic Substrates
    • Rosa María Llusar Barelles, Juan Manuel Andrés Bort, Eva María Guillamón Torres, Mónica Oliva Domínguez, Elena Pedrajas Gual, Vicente Sixto Safont Villarreal, A. G. Algarra, M.G. Basallote, M. J. Fernández Trujillo, J. A. Pino Chamorro. 43rd International Conference on Coordination Chemistry (ICCC 2018). Sendai (Japó). 30-07-2018. Científic. 2018.

    • Unprecedented sulfur centered mechanism of the catalytic hydrogenation of nitroarenes using Mo3S4clusters
    • Rosa María Llusar Barelles, Juan Manuel Andrés Bort, Eva María Guillamón Torres, Mónica Oliva Domínguez, Elena Pedrajas Gual, Vicente Sixto Safont Villarreal, A.G. Algarra, M.G. Basallote. ECIRM2018. European Colloquium on Inorganic Reaction Mecanisms 2018. Barcelona (Espanya). 08-07-2018. Científic. 2018.

    • Deciphering the reduction of nitrobencene catalyzed by a cubane-type Mo3S4 cluster: Mechanistic insights
    • Vicente Sixto Safont Villarreal, Juan Manuel Andrés Bort, Rosa María Llusar Barelles, Mónica Oliva Domínguez, Iván Sorribes Terrés, M.R. Rhyzhikov. European Colloquium on Inorganic Reaction Mecanisms (ECIRM 2018). Barcelona (Espanya). 08-07-2018. Científic. 2018.

    • Antifungal properties of silver tungstate (Ag2WO4) irradiated by electron and femtosecond laser
    • E. Longo, C.C. De Foggi, M. Assis, A. Kubo, P.A. Barbugli, C.E. Vergani, Juan Manuel Andrés Bort, Mónica Oliva Domínguez, María Gladis Mínguez Vega, Eloísa Cordoncillo Cordoncillo, Héctor Beltrán Mir, R. Torres Mendieta. V International Conference on Antimicrobial Research (ICAR 2018). Torremolinos (Espanya). 24-05-2018. Científic. 2018.

    • Ag-Bi nanoalloys: Synthesis by femtosecond laser irradiation and antibacterial activity against MRSA and MSSA
    • Juan Manuel Andrés Bort, C.C. Foggi, T.R. Machado, M. Assis, Mónica Oliva Domínguez, María Gladis Mínguez Vega, Eloísa Cordoncillo Cordoncillo, Héctor Beltrán Mir, C. Doñate Buendia, N.G. Macedo, M.M. Teixeira, Elson Longo. V International Conference on Antimicrobial Research (ICAR 2018). Torremolinos (Espanya). 24-05-2018. Científic. 2018.

    • Anionic magnesium-CO2 complexes obtention from the perspective of the bonding evolution theory
    • Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal, Gonzalez. P., Juan Manuel Andrés Bort. ESPA2016. Castelló (Espanya). 28-06-2016. Científic. 2016.

    • Theoretical Study of the binding of some classical inhibitors to Acetylcholinesterase
    • Erica Cristina Moreno Nascimento, Katarzyna Patrycja Swiderek, Mónica Oliva Domínguez, Juan Manuel Andrés Bort, B.L. Martins. 6th. Internacional Theoretical Biophysics Symposium (TheoBio 2013). Gothenburg, Sweden (Suècia). 24-06-2013. Científic. 2013.

    • Theoretical study of acetylchlinesterase inhibition (Pòsster)
    • Erica Cristina Moreno Nascimento, Katarzyna Patrycja Swiderek, Mónica Oliva Domínguez, Juan Manuel Andrés Bort, J.B. Lopes Martins. XXXVIII Congress of Theoretical Chemists of Latin Expression (QUITEL 2012.). Natal (Brasil). 02-12-2012. Científic. 2012.

    • Study of the mechanism of acylation of Acetylcholinesterase
    • Erica Cristina Moreno Nascimento, Juan Manuel Andrés Bort, Mónica Oliva Domínguez, Joao B. L. Martins. 8th Congress on Electronic Structure: Principles and Applications (ESPA2012). Barcelona (Espanya). 26-06-2012. Científic. 2012.

    • Modeling the O1 radical route of the artemisinin decomposition process: a topological study
    • Vicente Sixto Safont Villarreal, Mónica Oliva Domínguez, Pamela Moles Tena. Of the World Association of Theoretical and Computational Chemists (WATOC-2011). Santiago de Compostela. 22-07-2011. Científic. 2011.

    • Theoretical view of formate dehydrogenase mutations.
    • Raquel Castillo Solsona, Mónica Oliva Domínguez, Vicente Moliner Ibáñez. World Association of Theoretical and Computational Chemist (WATOC-2011). Santiago de Compostela. 17-07-2011. Científic. 2011.

    • A QM/MM study of the reaction mechanism catalyzed by LADH
    • Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal, O. Tapia, Vicente Moliner Ibáñez. Of the World Association of Theoretical and Computational Chemists (WATOC-2011). Santiago de Compostela. 17-07-2011. Científic. 2011.

    • A theoretical of the Dynamic Effects in Formate Dehydrogenase.
    • Mónica Oliva Domínguez, Raquel Castillo Solsona, M.Roca, Vicente Moliner Ibáñez, I. Tuñón. 7th Congress on Electronic Structure: Principles and Applications. Oviedo. 29-06-2010. Científic. 2010.

    • Artemisinin Decomposition prompted by Fe (II)-heme: a QM/MM study focused on antimalarial action
    • Pamela Moles Tena, Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal. Expanding the frontiers of molecular dynamics simulations in biology. Barcelona. 23-11-2009. Científic. 2009.

    • Modeling The O2-radical route of The Decomposition Of Artemisinin prompted By Fe(II): A Topological Study
    • Pamela Moles Tena, Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal. Theorical Biophysics International Symposium (Therbio 09). Roscoff. 29-06-2009. Científic. 2009.

    • Artemisinin Decomposition Induced by Fe(II)-heme: a Theorical Study
    • Mónica Oliva Domínguez, Pamela Moles Tena, Vicente Sixto Safont Villarreal. Theorical Chemistry: Modeling reactivity from gas phase to biomolecules and solids. Barcelona. 29-06-2009. Científic. 2009.

    • Dynamic Effects in a hydride transfer reaction catalyzed by Formate Dehydrogenase
    • María Teresa Roca Moliner, Mónica Oliva Domínguez, Raquel Castillo Solsona, Vicente Moliner Ibáñez, Iñaki Tuñón. Theoretical Chemistry: Modeling Reactivity From Gas Phase To Biomolecules and Solids. Barcelona. 29-06-2009. Científic. 2009.

    • Effects of Ionic Media on a Diels-Alder Reaction: A Theorical QM/MM Study
    • Raquel Castillo Solsona, Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal, Juan Manuel Andrés Bort, R. Contreras. Theoretical Chemistry: Modeling Reactivity From Gas Phase To Biomolecules and Solids. Barcelona. 29-06-2009. Científic. 2009.

    • Decomposition of 6,7,8-trioxybicyclo[3.2.2]nonane prompted by Fe (II). A model to study the first stages of the decomposition mechanism of artemisinin
    • Pamela Moles Tena, Vicente Sixto Safont Villarreal, Mónica Oliva Domínguez. Eight Triennial Congress of the World Association of Theoretical and Computacional Chemists. Sidney, Australia. 14-09-2008. Científic. 2008.

    • Theoretical study of the Fe(II)-catalysed Artemisinin decomposition in antimalarial activity
    • Pamela Moles Tena, Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal. 6th AFMC International Medicinal Chemistry Symposium. Estambul (Turquía). 08-07-2007. Científic. 2007.

    • A QM/MM study of the rate limiting step in the Formate Dehydrogenase
    • Raquel Castillo Solsona, Mónica Oliva Domínguez, Sergio Martí Forés, Vicente Moliner Ibáñez. Isotopes07. Benicàssim (Spain). 27-05-2007. Científic. 2007.

    • QM/MM Modelling of the formate ion oxydation to CO2 by formate dehydrogenase
    • Mónica Oliva Domínguez, Raquel Castillo Solsona, Sergio Martí Forés, Juan Manuel Andrés Bort, Vicente Moliner Ibáñez. 2006 ISQBP President's Meeting.. Estrasburgo (França). 24-06-2006. Científic. 2006.

    • QM/MM Modelling of the methanol oxydation by quinoprotein methanol dehydrogenase
    • Juan Manuel Andrés Bort, Raquel Castillo Solsona, Mónica Oliva Domínguez, Vicente Moliner Ibáñez. Quantum Atomic & Molecular Tunneling in Solids and Other Condensed Phases. Santiago de Compostela. 27-07-2005. Científic. 2005.

    • Computational study of Artemisinin decomposition in antimalarial activity
    • Pamela Moles Tena, Vicente Sixto Safont Villarreal, Mónica Oliva Domínguez. Theoretical Biophysics Symposium. Örebro University, Örebro (Sweden). 28-06-2005. Científic. 2005.

    • A QM/MM Study of the rate limiting step in the Formate Dehydrogenase
    • Mónica Oliva Domínguez, Raquel Castillo Solsona, Sergio Martí Forés, Juan Manuel Andrés Bort, Vicente Moliner Ibáñez. Computational Chemical Dynamics. Minnesota (Estats Units). 07-10-2004. Científic. 2004.

    • Theoretical study of the first stages of the Artemisinin antimalarial activity
    • Pamela Moles Tena, Vicente Sixto Safont Villarreal, Mónica Oliva Domínguez. Electronic Structure Principles and Applications 2004. Valladolid. 15-09-2004. Científic. 2004.

    • Estudi teòric de l'activitat farcamològica de l'artemisina
    • Pamela Moles Tena, Vicente Sixto Safont Villarreal, Mónica Oliva Domínguez. XX Reunió de la Xarxa de Química Teòrica. Barcelona. 12-07-2004. Científic. 2004.

    • b-Elimination of phosphate from the terminal intermediate by RuBP carboxylase; A density Functional Study
    • F. Tielens, Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal, Juan Manuel Andrés Bort. 2004 International Society of Quantum Biology and Pharmacology President's Meeting. Como (Itàlia). 05-06-2004. Científic. 2004.

    • QM/MM study of the acylation mechanism in Penicillin-binding Protein 2x from Streptococcus pneumoniae
    • Ramón Crehuet, Mónica Oliva Domínguez, Otto Dideberg, Martin J. Field. Modeling Chemical Reactivity: From Gas-Phase to Solution and Enzymes. Nancy (França). 16-07-2003. Científic. 2003.

    • QM/MM Modelling of the Rate Limiting Step Catalyzed by Formate Dehydrogenase: the Hydride Transfer
    • Mónica Oliva Domínguez, Raquel Castillo Solsona, Juan Manuel Andrés Bort, Vicente Moliner Ibáñez. Modeling Chemical Reactivity: From Gas-Phase to Solution and Enzymes.. Nancy (França). 16-04-2003. Científic. 2003.

    • Theoretical Study of the catalytic mechanism of Active-Site Serine Penicilli-Recognizing Proteins
    • Mónica Oliva Domínguez, O. Dideberg, M.J. Field. Molecular Graphics and Modelling Society Model(I)ing 2001. Erlangen, Germany. 16-09-2001. Científic. 2001.

    • A QM/MM Theoretical Study of Enzyme Reaction Mechanism. An Analysis of the Electrostatic and Mechanical Contributions
    • Vicente Moliner Ibáñez, Sergio Martí Forés, Raquel Castillo Solsona, Mónica Oliva Domínguez, Juan Manuel Andrés Bort, I. Tuñón, E. Silla, J. Bertrán, M.J. Field, P. Sherwood, I.H. Williams. Electronic Structure: Prediction and Applications. Donostia. 04-10-2000. Científic. 2000.

    • Estudios Teóricos de Reacciones Enzimáticas mediante Técnicas Híbridas QM/MM
    • Vicente Moliner Ibáñez, Sergio Martí Forés, Raquel Castillo Solsona, Mónica Oliva Domínguez, Juan Manuel Andrés Bort, I. Tuñón, E. Silla, J. Bertran, J. Field, I.H. Williams. XXVI Congresso dos Químicos Teóricos de Expressao Latina. Caxambu (Brasil). 03-09-2000. Científic. 2000.

    • QM/MM Modelling of Oxydation of Formate to CO2 in the Active Site of Formate Dehydrogenase
    • Mónica Oliva Domínguez, Raquel Castillo Solsona, Vicente Sixto Safont Villarreal, Juan Manuel Andrés Bort, Vicente Moliner Ibáñez, P. Sherwood, Ian H. Williams. Computational Biophysics 2000. Nice. 13-06-2000. Científic. 2000.

    • Intramolecular Decomposition of (H-Halo)-Alcoholamines. A Simple Model for the Intracellular Oxidation of Amino Acids and Peptides
    • Juan Manuel Andrés Bort, M. Canle L., M.V. García, Mónica Oliva Domínguez, D.R. Ramos, J.A. Santaballa. Computational Biophysics 2000. Nice. 13-06-2000. Científic. 2000.

    • Theoretical Studies on the Gas Phase Decompositions of Several Carboxylic Acid Derivatives.
    • Vicente Sixto Safont Villarreal, Juan Manuel Andrés Bort, Mónica Oliva Domínguez, Raquel Castillo Solsona, Vicente Moliner Ibáñez, L.R. Domingo, G. Chuchani. 5th World Congress of Theoretically Oriented Chemists WATOC99. Londres. 01-08-1999. Científic. 1999.

    • A QM/MM Study of the molecular mechanism in the reactions catalysed by Rubisco: Transition State Structure Invariance to Model System and Calculation Levels.
    • Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal, Vicente Moliner Ibáñez, Juan Manuel Andrés Bort, O. Tapia. 5th World Congress of Theoretically Oriented Chemists WATOC99. Londres. 01-08-1999. Científic. 1999.

    • Theoretical Study of Enzyme Reaction Mechanisms by a Hybrid QM/MM Method.
    • Vicente Moliner Ibáñez, Vicente Sixto Safont Villarreal, Raquel Castillo Solsona, Sergio Martí Forés, Mónica Oliva Domínguez, Juan Manuel Andrés Bort, A. J. Turner, I.A. Williams. 5th World Congress of Theoretically Oriented Chemists WATOC99. Londres. 01-08-1999. Científic. 1999.

    • Estructura i Reactivitat Química. Efectes del Medi: Dissolvent i Enzims
    • Juan Manuel Andrés Bort, Armando Beltrán Flors, Rosa María Llusar Barelles, Vicente Sixto Safont Villarreal, Vicente Moliner Ibáñez, Joaquín Jose Queralt Gimeno, Mónica Oliva Domínguez, Raquel Castillo Solsona, Sergio Martí Forés, Mònica Calatayud Antonino. XV Reunió del Grup de Química Teòrica de Catalunya. Bellaterra (Espanya). 14-06-1999. Científic. 1999.

    • Theoretical modelling of reaction mechanisms by a hybrid QM/MM method
    • Vicente Moliner Ibáñez, Vicente Sixto Safont Villarreal, Raquel Castillo Solsona, Sergio Martí Forés, Mónica Oliva Domínguez, Juan Manuel Andrés Bort. Molecular Structure and Dynamics in Biology. Elba (Itàlia). 08-09-1998. Científic. 1998.

    • Molecular mechanisms for the carboxylation and oxygenation sequences catalyzed by Rubisco Enzyme.
    • Vicente Sixto Safont Villarreal, Vicente Moliner Ibáñez, Mónica Oliva Domínguez, Raquel Castillo Solsona, Juan Manuel Andrés Bort, Orlando Tapia. Molecular Structure and Dynamics in Biology. Elba (Itàlia). 08-09-1998. Científic. 1998.

    • QM/MM Transition Structure Characterization for Enzyme Molecular Mechanisms
    • Vicente Moliner Ibáñez, Raquel Castillo Solsona, Sergio Martí Forés, Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal, Juan Manuel Andrés Bort, I. Tuñón, E. Silla, I.H. Williams, A.J. Turner, O. Tapia. European Conference: Computational Chemistry and the Living World. From Sequence to Function. Chambery. 20-04-1998. Científic. 1998.

    • Computational Chemistry Applied to Enzyme Catalysis: The Rubisco Case.
    • Juan Manuel Andrés Bort, Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal, Vicente Moliner Ibáñez, O. Tapia. European Conference: Computational Chemistry and the Living World. From Sequence to Function. Chambery (França). 20-04-1998. Científic. 1998.

    • Transition Structure Invariances in Rubisco Catalytic Mechanism: Modelling the Magnesium Coordination Sphere effects on TSs
    • Mónica Oliva Domínguez, Vicente Sixto Safont Villarreal, Raquel Castillo Solsona, Juan Manuel Andrés Bort, Orlando Tapia. Third European Workshop on Quantum Systems in Chemistry and Physics. Granada. 19-04-1998. Científic. 1998.

    • A Hybrid QM/MM Theoretical Study of the Favorskii Rearrangement
    • Raquel Castillo Solsona, Sergio Martí Forés, Mónica Oliva Domínguez, Vicente Moliner Ibáñez, Juan Manuel Andrés Bort. Third European Workshop on Quantum Systems in Chemistry and Physics. Granada. 19-04-1998. Científic. 1998.

    Comités de congresos


    • Juan Manuel Andrés Bort, Armando Beltrán Flors, Vicente Moliner Ibáñez, Vicente Sixto Safont Villarreal, Raquel Castillo Solsona, Silvia Ferrer Castillo, Lourdes Gracia Edo, Rosa María Llusar Barelles, Sergio Martí Forés, Mónica Oliva Domínguez, José Javier Ruiz Pernia, María Teresa Roca Moliner. 10th Congress on Electronic Structure: Principles and Applications (ESPA2016). Castellón (Espanya). 28-06-2016. Científic.

    Referee de publicacions periòdiques


    • Mónica Oliva Domínguez. 2003 JOURNAL OF PHYSICAL ORGANIC CHEMISTRY.