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1

Effect of white mustard cover crop residue, soil chemical fumigation and Trichoderma spp. root treatment on black-foot disease control in grapevine

Berlanas, Carmen, Andrés-Sodupe, Marcos, López-Manzanares, Beatriz, Maldonado-González, María Mercedes, Gramaje, David

Journal:

Pest Management Science

Year:

2018

Language:

english

File:

PDF, 1.27 MB

english, 2018

2

Screening of Spanish Vitis vinifera germplasm for resistance to Phaeomoniella chlamydospora

Martínez-Diz, María del Pilar, Díaz-Losada, Emilia, Barajas, Enrique, Ruano-Rosa, David, Andrés-Sodupe, Marcos, Gramaje, David

Journal:

Scientia Horticulturae

Year:

2019

Language:

english

File:

PDF, 1.03 MB

english, 2019

3

Soil-plant compartments affect fungal microbiome diversity and composition in grapevine

Martínez-Diz, María del Pilar, Andrés-Sodupe, Marcos, Bujanda, Rebeca, Díaz-Losada, Emilia, Eichmeier, Ales, Gramaje, David

Journal:

Year:

2019

Language:

english

File:

PDF, 1.88 MB

english, 2019

4

Silica Surface Features and Their Role in the Adsorption of Biomolecules: Computational Modeling and Experiments

Rimola, Albert, Costa, Dominique, Sodupe, Mariona, Lambert, Jean-François, Ugliengo, Piero

Journal:

Chemical Reviews

Year:

2013

Language:

english

File:

PDF, 48.21 MB

english, 2013

5

Evaluation of crumb rubber as aggregate for automated manufacturing of rubberized long hollow blocks and bricks

Sodupe-Ortega, E., Fraile-Garcia, E., Ferreiro-Cabello, J., Sanz-Garcia, A.

Journal:

Construction and Building Materials

Year:

2016

Language:

english

File:

PDF, 3.73 MB

english, 2016

6

Occurrence and diversity of black-foot disease fungi in symptomless grapevine nursery stock in Spain

Berlanas, Carmen, Ojeda, Sonia, López-Manzanares, Beatriz, Andrés-Sodupe, Marcos, Bujanda, Rebeca, Martinez-Diz, Maria del Pilae, Diaz-Losada, Emilia, Gramaje, David

Journal:

Year:

2019

Language:

english

File:

PDF, 2.53 MB

english, 2019

7

A Versatile Open-Source Printhead for Low-Cost 3D Microextrusion-Based Bioprinting

Sanz-Garcia, Andres, Sodupe-Ortega, Enrique, PernÃa-Espinoza, Alpha, Shimizu, Tatsuya, Escobedo-Lucea, Carmen

Journal:

Year:

2020

File:

PDF, 2.76 MB

2020

8

Structures and Stabilities of Fe2+/3+ Complexes Relevant to Alzheimer’s Disease: An ab Initio Study

Alí-Torres, Jorge, Rodríguez-Santiago, Luis, Sodupe, Mariona, Rauk, Arvi

Journal:

Journal of Physical Chemistry A

Year:

2011

Language:

english

File:

PDF, 1.74 MB

english, 2011

9

Hydrogen bonding and aromaticity in the guanine–cytosine base pair interacting with metal cations (M = Cu + , Ca 2+ and Cu 2+ )

Poater, Jordi, Sodupe, Mariona, Bertran *, Joan, Solà *, Miquel

Journal:

Molecular Physics

Year:

2005

Language:

english

File:

PDF, 271 KB

english, 2005

10

Diels-Alder cycloadditions of electron-rich, electron-deficient, and push-pull dienes with cyclic dienophiles: high-pressure-induced reactions and theoretical calculations

Branchadell, Vicenc, Sodupe, Mariona, Ortuno, Rosa M., Oliva, Antonio, Gomez-Pardo, Domingo, Guingant, Andre, D'Angelo, Jean

Journal:

Journal of Organic Chemistry

Year:

1991

Language:

english

File:

PDF, 782 KB

english, 1991

11

Binding of Thioflavin T and Related Probes to Polymorphic Models of Amyloid-β Fibrils

Peccati, Francesca, Pantaleone, Stefano, Riffet, Vanessa, Solans-Monfort, Xavier, Contreras-García, Julia, Guallar, Victor, Sodupe, Mariona

Journal:

Journal of Physical Chemistry B

Year:

2017

Language:

english

File:

PDF, 1.48 MB

english, 2017

12

Breve historia y largo futuro del ebook

Armañanzas Sodupe, Emy

Journal:

Historia y Comunicación Social

Year:

2014

File:

PDF, 366 KB

2014

13

Theoretical study of ScCO2+

Mariona Sodupe, Vicenç Branchadell, Antonio Oliva, Juan Bertran

Journal:

International Journal of Quantum Chemistry

Year:

1997

Language:

english

File:

PDF, 165 KB

english, 1997

14

Gas Phase Intramolecular Proton Transfer in Cationized Glycine and Chlorine Substituted Derivatives (M–Gly, M=Na+, Mg2+, Cu+, Ni+, and Cu2+): Existence of Zwitterionic Structures?

Sallaraisa Pulkkinen, Marc Noguera, Luis Rodríguez-Santiago, Mariona Sodupe, Juan Bertran

Journal:

Chemistry - A European Journal

Year:

2000

Language:

english

File:

PDF, 194 KB

english, 2000

15

Realistic Models of Hydroxylated Amorphous Silica Surfaces and MCM-41 Mesoporous Material Simulated by Large-scale Periodic B3LYP Calculations

P. Ugliengo, M. Sodupe, F. Musso, I. J. Bush, R. Orlando, R. Dovesi

Journal:

Advanced Materials

Year:

2008

Language:

english

File:

PDF, 502 KB

english, 2008

16

Mechanismus der metallvermittelten Desaminierung von Cytosin – Experiment und DFT-Rechnungen

Judit E. Šponer, Pablo J. Sanz Miguel, Luis Rodríguez-Santiago, Andrea Erxleben, Michael Krumm, Mariona Sodupe, Jiří Šponer, Bernhard Lippert

Journal:

Angewandte Chemie

Year:

2004

Language:

german

File:

PDF, 169 KB

german, 2004

17

Metal-Mediated Deamination of Cytosine: Experiment and DFT Calculations

Judit E. Šponer, Pablo J. Sanz Miguel, Luis Rodríguez-Santiago, Andrea Erxleben, Michael Krumm, Mariona Sodupe, Jirí Šponer, Bernhard Lippert

Journal:

Angewandte Chemie International Edition

Year:

2004

Language:

english

File:

PDF, 168 KB

english, 2004

18

DFT Mechanistic Study on Diene Metathesis Catalyzed by Ru-Based Grubbs–Hoveyda-Type Carbenes: The Key Role of π-Electron Density Delocalization in the Hoveyda Ligand

Xavier Solans-Monfort, Roser Pleixats, Mariona Sodupe

Journal:

Chemistry - A European Journal

Year:

2010

Language:

english

File:

PDF, 631 KB

english, 2010

19

Mechanistic Insights into Ring-Closing Enyne Metathesis with the Second-Generation Grubbs–Hoveyda Catalyst: A DFT Study

Dipl. Chem. Francisco Nuñez-Zarur, Dr. Xavier Solans-Monfort, Dr. Luis Rodríguez-Santiago, Prof. Roser Pleixats, Prof. Mariona Sodupe

Journal:

Chemistry - A European Journal

Year:

2011

Language:

english

File:

PDF, 1.32 MB

english, 2011

20

PtII Coordination to N1 of 9-Methylguanine: Why it Facilitates Binding of Additional Metal Ions to the Purine Ring

Dr. Barbara Müller, Dr. Wei-Zheng Shen, Dr. Pablo J. Sanz Miguel, Dr. Francisca M. Albertí, Dr. Tushar van der Wijst, Dr. Marc Noguera, Dr. Luis Rodríguez-Santiago, Prof. Mariona Sodupe, Prof. Bernhar

Journal:

Chemistry - A European Journal

Year:

2011

Language:

english

File:

PDF, 1.35 MB

english, 2011

21

ChemInform Abstract: Potential Energy Profiles of Proton Transfer Processes in Cationic Clusters

J. Bertran, A. Oliva, L. Rodriguez-Santiago, M. Sodupe

Journal:

Year:

2000

File:

PDF, 24 KB

2000

22

Inter- and Intramolecular Proton Transfer Processes in Ionized Hydrogen Bonded Systems

J. Bertran, L. Rodriguez-Santiago, M. Sodupe

Journal:

Year:

2003

File:

PDF, 50 KB

2003

23

Can Cu+-Exchanged Zeolites Store Molecular Hydrogen? An ab initio Periodic Study Compared with Low-Temperature FTIR.

Xavier Solans-Monfort, Vicenc Branchadell, Mariona Sodupe, Claudio M. Zicovich-Wilson, Evgueny Gribov, Giuseppe Spoto, Claudia Busco, Piero Ugliengo

Journal:

Year:

2004

File:

PDF, 56 KB

2004

24

Ground and Low-Lying States of Cu2+—H2O. A Difficult Case for Density Functional Methods.

J. Poater, M. Sola, A. Rimola, L. Rodriguez-Santiago, M. Sodupe

Journal:

Year:

2004

File:

PDF, 17 KB

2004

25

Does Silica Surface Catalyse Peptide Bond Formation? New Insights from First-Principles Calculations

Albert Rimola, Sergio Tosoni, Mariona Sodupe, Piero Ugliengo

Journal:

Year:

2006

Language:

english

File:

PDF, 364 KB

english, 2006

26

Bent and Linear Forms of the (μ-Oxo)bis[trichloroferrate(III)] Dianion: An Intermolecular Effect − Structural, Electronic and Magnetic Properties

Agustí Lledós, Marcial Moreno-Mañas, Mariona Sodupe, Adelina Vallribera, Ignasi Mata, Benjamín Martínez, Elies Molins

Journal:

European Journal of Inorganic Chemistry

Year:

2003

Language:

english

File:

PDF, 208 KB

english, 2003

27

A Theoretical Study on PdII Complexes Containing Hemilabile Pyrazole-Derived Ligands

Albert Rimola, Mariona Sodupe, Josep Ros, Josefina Pons

Journal:

European Journal of Inorganic Chemistry

Year:

2006

Language:

english

File:

PDF, 272 KB

english, 2006

28

Influence of ionization on the conformational preferences of peptide models. Ramachandran surfaces of N-formyl-glycine amide and N-formyl-alanine amide radical cations

Adrià Gil, Mariona Sodupe, Juan Bertran

Journal:

Journal of Computational Chemistry

Year:

2009

Language:

english

File:

PDF, 2.22 MB

english, 2009

29

A theoretical study of Mg(CO2)+n and Sr(CO2)+n for n = 1 and 2 and Mg2CO+2

Mariona Sodupe, Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 783 KB

english, 1992

30

Theoretical study of the 2A22B2 separation of the alkali superoxides

Charles W. Bauschlicher Jr., Mariona Sodupe, Harry Partridge, Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 370 KB

english, 1992

31

Theoretical determination of the alkali-metal superoxide bond energies

Harry Partridge, Charles W. Bauschlicher Jr., Mariona Sodupe, Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 459 KB

english, 1992

32

The bonding in FeC5H+5

Mariona Sodupe, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 348 KB

english, 1993

33

The bonding in the low-lying states of MgO+2

Mariona Sodupe, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 455 KB

english, 1993

34

A theoretical study of the spectroscopy of SrH2O+ and SrNH+3

Mariona Sodupe, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 576 KB

english, 1993

35

A study of the ground and low-lying states of MgCH+4

Charles W. Bauschlicher Jr., Mariona Sodupe

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 549 KB

english, 1993

36

What is the structure of FeC5H6+?

Charles W. Bauschlicher Jr., Mariona Sodupe

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 659 KB

english, 1995

37

Generalized singular values, interlacing inequalities, and monotonic norms

Eduardo Marques de Sá, María José Sodupe

Journal:

Linear Algebra and its Applications

Year:

1991

Language:

english

File:

PDF, 773 KB

english, 1991

38

Characterizations of ∗orthant-monotonic norms

Eduardo Marques de Sá, Maria-José Sodupe

Journal:

Linear Algebra and its Applications

Year:

1993

Language:

english

File:

PDF, 530 KB

english, 1993

39

Matrix pencil generated by a tensor product from two matrix pencils

Juan-Miguel Gracia, Lourdes Ortiz de Elguea, María-José Sodupe

Journal:

Linear Algebra and its Applications

Year:

1996

Language:

english

File:

PDF, 918 KB

english, 1996

40

A study of the ground and low-lying states of MgC2H2+ and MgC2H4+

Mariona Sodupe, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics

Year:

1994

Language:

english

File:

PDF, 817 KB

english, 1994

41

Gas phase reactivity of Cu+-aromatic amino acids: An experimental and theoretical study

A. Rimola, M. Sodupe, J. Tortajada, L. Rodríguez-Santiago

Journal:

International Journal of Mass Spectrometry

Year:

2006

Language:

english

File:

PDF, 1006 KB

english, 2006

42

Basic and acidic bifunctional catalysis: application to the tautomeric equilibrium of formamide

Erika Constantino, Xavier Solans-Monfort, Mariona Sodupe, Juan Bertran

Journal:

Chemical Physics

Year:

2003

Language:

english

File:

PDF, 493 KB

english, 2003

43

Unusual hydrogen bonds in [AH3–H3O]+ radical cations (A = C, Si, Ge, Sn and Pb): Single-electron hydrogen bond, proton-hydride hydrogen bond and formation of [H2AOH2]+–H2 complexes

Adrià Gil, Mariona Sodupe, Joan Bertran

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 449 KB

english, 2004

44

Peptide bond formation activated by the interplay of Lewis and Brønsted catalysts

Albert Rimola, Sergio Tosoni, Mariona Sodupe, Piero Ugliengo

Journal:

Chemical Physics Letters

Year:

2005

Language:

english

File:

PDF, 1.00 MB

english, 2005

45

How the site of ionisation influences side-chain fragmentation in histidine radical cation

Adrià Gil, Sílvia Simon, Mariona Sodupe, Juan Bertrán

Journal:

Chemical Physics Letters

Year:

2008

Language:

english

File:

PDF, 759 KB

english, 2008

46

Structure and fragmentation of glycine, alanine, serine and cysteine radical cations. A theoretical study

Sílvia Simon, Adrià Gil, Mariona Sodupe, Juan Bertrán

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2005

Language:

english

File:

PDF, 257 KB

english, 2005

47

Solvent-assisted catalysis in the enolization of acetaldehyde radical cation

L. Rodrı́guez-Santiago, O. Vendrell, I. Tejero, M. Sodupe, J. Bertran

Journal:

Chemical Physics Letters

Year:

2001

Language:

english

File:

PDF, 206 KB

english, 2001

48

Spin-forbidden N2O dissociation in Cu–ZSM-5

Xavier Solans-Monfort, Mariona Sodupe, Vicenç Branchadell

Journal:

Chemical Physics Letters

Year:

2003

Language:

english

File:

PDF, 193 KB

english, 2003

49

Atomic reference energies for density functional calculations

E.J. Baerends, V. Branchadell, M. Sodupe

Journal:

Chemical Physics Letters

Year:

1997

Language:

english

File:

PDF, 613 KB

english, 1997

50

Water-catalyzed isomerization of the glycine radical cation. From hydrogen-atom transfer to proton-transport catalysis

Sílvia Simon, Mariona Sodupe, Joan Bertran

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2004

Language:

english

File:

PDF, 265 KB

english, 2004