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1

Arbuscular mycorrhizal fungi and potassium bicarbonate enhance the foliar content of the vinblastine alkaloid inCatharanthus roseus

Claudia Janette De la Rosa-Mera, Ronald Ferrera-Cerrato, Alejandro Alarcón, María de Jesús Sánchez-Colín, Omar David Muñoz-Muñiz

Journal:

Year:

2011

File:

PDF, 321 KB

2011

2

Standardized extract of Dicksonia sellowiana Presl. Hook (Dicksoniaceae) decreases oxidative damage in cultured endothelial cells and in rats

Yanna D. Rattmann, Stelia C. Mendéz-Sánchez, Ana F. Furian, Katia S. Paludo, Lauro Mera de Souza, Nessana Dartora, Mauro S. Oliveira, Elisangela Martins da S. Costa, Obdúlio G. Miguel, Guilherme Lanzi

Journal:

Journal of Ethnopharmacology

Year:

2011

Language:

english

File:

PDF, 519 KB

english, 2011

3

Structure-Based Design of New KSP-Eg5 Inhibitors Assisted by a Targeted Multicomponent Reaction

Carbajales, Carlos, Prado, Miguel Ángel, Gutiérrez-de-Terán, Hugo, Cores, Ángel, Azuaje, Jhonny, Novio, Silvia, Nuñez, María Jesús, Fernández-García, Belén, Sotelo, Eddy, García-Mera, Xerardo, Sánchez

Journal:

Year:

2014

Language:

english

File:

PDF, 1.22 MB

english, 2014

4

From Pentalene to Dicyclopenta[b,g]naphthalene, or the Change towards Delocalized Structures

Inmaculada García Cuesta, Sonia Coriani, Paolo Lazzeretti, Alfredo M. J. Sánchez de Merás

Journal:

Year:

2006

Language:

english

File:

PDF, 136 KB

english, 2006

5

Theoretical Study on the Structures and Electronic Spectra of TCNE2−

Inmaculada García Cuesta, José Sánchez-Marín, Alfredo M. J. Sánchez de Merás

Journal:

Year:

2006

Language:

english

File:

PDF, 98 KB

english, 2006

6

Carbon Nanorings: A Challenge to Theoretical Chemistry

I. García Cuesta, T. B. Pedersen, H. Koch, A. Sánchez de Merás

Journal:

Year:

2006

Language:

english

File:

PDF, 195 KB

english, 2006

7

Electronic Structure of the Ground and Excited States of β-Carboline

Vicente Pérez Mondéjar, Inmaculada García Cuesta, Paolo Lazzeretti, José Sánchez-Marín, Alfredo Sánchez de Merás

Journal:

Year:

2008

Language:

english

File:

PDF, 276 KB

english, 2008

8

Structure, magnetizability, and nuclear magnetic shielding tensors of bis-heteropentalenes. IV. Dihydrophospholophosphole isomers

Inmaculada García Cuesta, Alfredo M. J. Sánchez De Merás, Paolo Lazzeretti

Journal:

Journal of Computational Chemistry

Year:

2006

Language:

english

File:

PDF, 419 KB

english, 2006

9

Diatropicity of tetraazanaphthalenes

I. García Cuesta, A. Sánchez de Merás, P. Lazzeretti

Journal:

Journal of Computational Chemistry

Year:

2006

Language:

english

File:

PDF, 585 KB

english, 2006

10

Understanding the ring current effects on magnetic shielding of hydrogen and carbon nuclei in naphthalene and anthracene

Inmaculada Garíca Cuesta, Alfredo Sánchez De Merás, Stefano Pelloni, Paolo Lazzeretti

Journal:

Journal of Computational Chemistry

Year:

2009

Language:

english

File:

PDF, 3.74 MB

english, 2009

11

Excitation energies, transition moments and dynamic polarizabilities for CH+. A comparison of multiconfigurational linear response and full configuration interaction calculations

Jeppe Olsen, Alfredo M.Sánchez De Meŕas, Hans Jørgen Aa. Jensen, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 582 KB

english, 1989

12

Theoretical spectroscopic parameters of the alkali monofluorides LiF, NaF and KF

I. García-Cuesta, L. Serrano-Andrés, A. Sánchez de Merás, I. Nebot-Gil

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 818 KB

english, 1992

13

Reply to comment on “A MRCI PS and CASSCF study of the ground state MgO dissociation energy”

I. Garcia Cuesta, A. Sánchez de Merás, I. Nebot Gil

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 235 KB

english, 1993

14

Photodissociation of β-carboline

A. Sánchez-de-Merás, J. Planelles, J.M. Aulló, F. Tomás

Journal:

Journal of Photochemistry

Year:

1986

Language:

english

File:

PDF, 665 KB

english, 1986

15

A mutliconfigurational study of low-lying electronic states of KO

Luis Serrano-Andrés, Alfredo Sánchez de Merás, Rosendo Pou-Amérigo, Ignacio Nebot-Gil

Journal:

Chemical Physics

Year:

1992

Language:

english

File:

PDF, 1.12 MB

english, 1992

16

Binding and isomerization energies for the Cu/CN and Cu(I)CN interactions

I. García Cuesta, A. Sánchez de Merás, I. Nebot Gil

Journal:

Chemical Physics

Year:

1993

Language:

english

File:

PDF, 757 KB

english, 1993

17

Polarizabilities of small annulenes from Cholesky CC2 linear response theory

I. Garcı́a Cuesta, T. Bondo Pedersen, H. Koch, A.M.J. Sánchez de Merás

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 182 KB

english, 2004

18

Origin invariant calculation of optical rotation without recourse to London orbitals

Thomas Bondo Pedersen, Henrik Koch, Linus Boman, Alfredo M.J Sánchez de Merás

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 191 KB

english, 2004

19

The ring-current model of the paratropic pentalene molecule

I. Garcı́a Cuesta, A. Ligabue, A. Sánchez de Merás, P. Lazzeretti

Journal:

Chemical Physics Letters

Year:

2005

Language:

english

File:

PDF, 806 KB

english, 2005

20

Coupled cluster calculations of interaction energies in benzene–fluorobenzene van der Waals complexes

Berta Fernández, Thomas Bondo Pedersen, Alfredo Sánchez de Merás, Henrik Koch

Journal:

Chemical Physics Letters

Year:

2007

Language:

english

File:

PDF, 128 KB

english, 2007

21

A coupled cluster calculation of the spectrum of urea

Alfredo M.J Sánchez de Merás, Inmaculada Garcı́a Cuesta, Henrik Koch

Journal:

Chemical Physics Letters

Year:

2001

Language:

english

File:

PDF, 88 KB

english, 2001

22

Size-consistent ab initio calculation of the electric quadrupole moment of Cl2

J.M. Junquera-Hernández, J. Sánchez-Marı&amp, #x0301, n, V. Pérez-Mondéjar, A.Sánchez de Merás

Journal:

Chemical Physics Letters

Year:

2003

Language:

english

File:

PDF, 231 KB

english, 2003

23

The CCSD(T) model with Cholesky decomposition of orbital energy denominators

Javier López Cacheiro, Thomas Bondo Pedersen, Berta Fernández, Alfredo Sánchez De Merás, Henrik Koch

Journal:

International Journal of Quantum Chemistry

Year:

2011

Language:

english

File:

PDF, 100 KB

english, 2011

24

Parker Flex-Tip tube for fibreoptic nasotracheal intubation in a case of lingual tonsil hypertrophy

José Higueras, Xavier Onrubia, Amparo Sánchez de Merás, Maria Estruch, Manuel Barberá

Journal:

Canadian Journal of Anesthesia/Journal canadien d'anesthésie

Year:

2005

Language:

english

File:

PDF, 456 KB

english, 2005

25

Vertical excitation energies to valence states of DMS and DMSO

V. Pérez Mondéjar, M. J. Yusá, I. García Cuesta, A. M. J. Sánchez de Merás, J. Sánchez-Marín

Journal:

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

Year:

2007

Language:

english

File:

PDF, 127 KB

english, 2007

26

Electronic spectrum of F2CO: theoretical calculations of vertical excitation energies and intensities

C. Lavín, A. M. Velasco, I. Martín, J. V. Pitarch-Ruíz, A. M. J. Sánchez de Merás, J. Sánchez-Marín

Journal:

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

Year:

2011

Language:

english

File:

PDF, 255 KB

english, 2011

27

Restricted and complete-active-space multiconfiguration linear response calculations of the polarizability of formamide and urea

Alfredo M. Sanchez de Merás, Hans Jørgen Aa. Jensen, Poul Jørgensen, Jeppe Olsen

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 544 KB

english, 1991

28

A MRCI PS and CASSCF study of the ground state MgO dissociation energy

I. García Cuesta, A. Sánchez de Merás, I. Nebot Gil

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 656 KB

english, 1991

29

The use of polarized atomic orbitals in the initial guess in mcscf calculations

Alfredo M.J. Sánchez De Merás, Francisco Torrens Zaragozá, Ignacio Nebot Gil

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1992

Language:

english

File:

PDF, 386 KB

english, 1992

30

MCSCF determination of the KO molecule ground state.: CAS and basis set dependence

Luis Serrano-Andrés, Alfredo Sánchez de Merás, Rosendo Pou-Amérigo, Ignacio Nebot-Gil

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1992

Language:

english

File:

PDF, 908 KB

english, 1992

31

Dissociation energies within selected configuration interaction and perturbation theory

Inmaculada García-Cuesta, Luis Serrano-Andrés, Alfredo Sánchez de Merás, Ignacio Nebot-Gil

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1993

Language:

english

File:

PDF, 1.02 MB

english, 1993

32

Discontinuity of valence CASSCF wave functions around weakly avoided crossing between valence configurations

Alfredo Sanchez de Meras, Marie-Bernadette Lepetit, Jean-Paul Malrieu

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 539 KB

english, 1990

33

Host—guest stabilized room temperature phosphorescence in β-cyclodextrin/ bromoalcohol solutions from 2-naphthyl-oxy-acetic acid and 1-naphthyl-acetic acid

A.Munoz de la Pena, F. Salinas, M.J. Gomez, M. Sanchez-Pena, I. Duran-Meras

Journal:

Year:

1993

Language:

english

File:

PDF, 884 KB

english, 1993

34

The use of “ab initio” net charges to improve Fraga's atom-atom pair potential for molecular association

Francisco Torrens, Alfredo-Manuel Sánchez-de-Merás, José Sánchez-Marín

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1988

Language:

english

File:

PDF, 207 KB

english, 1988

35

Energy interactions in amyloid-like fibrils from NNQQNY

Cuesta, Inmaculada García, Sánchez de Merás, Alfredo M. J.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.75 MB

english, 2014

36

Tratamiento de la vía aérea en un caso de enfermedadde Madelung o lipomatosis cervical

Diago, L. Gómez, Cádiz, M. J. Hernández, Higueras Guerrero, J., Sánchez de Merás, A.

Journal:

Revista Española de Anestesiología y Reanimación

Year:

2012

File:

PDF, 388 KB

2012

37

Standardized Models for Project Management Processes to Product Design

Sánchez, Prado Díaz de Mera, Gaya, Cristina González, Peréz, Miguel Ángel Sebastián

Journal:

Procedia Engineering

Year:

2013

Language:

english

File:

PDF, 251 KB

english, 2013

38

Low-Lying Rydberg States of HCl

Pitarch-Ruiz, J., Sánchez de Merás, A., Sánchez-Marín, J., Velasco, A. M., Lavín, C., Martín, I.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 56 KB

english, 2008

39

Current density maps, magnetizability, and nuclear magnetic shielding tensors of bis-heteropentalenes. III. Thieno-thiophene isomers

Cuesta, I. García, Jartín, R. Soriano, de Merás, A. Sánchez, Lazzeretti *, P.

Journal:

Molecular Physics

Year:

2005

Language:

english

File:

PDF, 508 KB

english, 2005

40

Multi-scale theoretical investigation of molecular hydrogen adsorption over graphene: coronene as a case study

Yeamin, Md Bin, Faginas-Lago, N., Albertí, M., Cuesta, I. G., Sánchez-Marín, J., Sánchez de Merás, A. M. J.

Journal:

Year:

2014

Language:

english

File:

PDF, 889 KB

english, 2014

41

Excitation Energies and Photoabsorption Oscillator Strengths of the Rydberg Series in CF 3 Cl. A Linear Response and Quantum Defect Study

Pitarch-Ruiz, J., Sánchez de Merás, A., Sánchez-Marín, J., Mayor, E., Velasco, A. M., Martín, I.

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 47 KB

english, 2007

42

A coupled-cluster study of lanthanum trihalide structures

Jansik, Branislav, Sanchez de Meras, Alfredo M. J., Schimmelpfennig, Bernd, ??gren, Hans

Journal:

Journal of the Chemical Society Dalton Transactions

Year:

2002

Language:

english

File:

PDF, 80 KB

english, 2002

43

Assessment of the CTOCD-DZ method in a hierarchy of coupled cluster methods

Cuesta, I. García, Marín, J. Sánchez, de Merás, A. Sánchez, Pawłowski, F., Lazzeretti, P.

Journal:

Physical Chemistry Chemical Physics

Year:

2010

Language:

english

File:

PDF, 1.15 MB

english, 2010

44

How nitrogen modifies the nuclear magnetic shielding in tetraazanaphthalenes

Cuesta, Inmaculada García, Marín, José Sánchez, Sánchez de Merás, Alfredo M. J.

Journal:

Physical Chemistry Chemical Physics

Year:

2009

Language:

english

File:

PDF, 1.11 MB

english, 2009

45

The vertical spectrum of H 2 CO revisited: (SC) 2 -CI and CC calculations

PITARCH-RUIZ, JOSE, SANCHEZ-MARIN, JOSE, DE MERAS, ALFREDO SANCHEZ, MAYNAU, DANIEL

Journal:

Molecular Physics

Year:

2003

Language:

english

File:

PDF, 1.08 MB

english, 2003

46

Calculation of size-intensive transition moments from the coupled cluster singles and doubles linear response function

Koch, Henrik, Kobayashi, Rika, Sanchez de Merás, Alfredo, Jo̸rgensen, Poul

Journal:

The Journal of Chemical Physics

Year:

1994

Language:

english

File:

PDF, 836 KB

english, 1994

47

The CC3 model: An iterative coupled cluster approach including connected triples

Koch, Henrik, Christiansen, Ove, Jo̸rgensen, Poul, Sanchez de Merás, Alfredo M., Helgaker, Trygve

Journal:

The Journal of Chemical Physics

Year:

1997

Language:

english

File:

PDF, 428 KB

english, 1997

48

Calculation of excitation energies from the CC2 linear response theory using Cholesky decomposition

Baudin, Pablo, Marín, José Sánchez, Cuesta, Inmaculada García, Sánchez de Merás, Alfredo M. J.

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 743 KB

english, 2014

49

Assessment for the mean value total dressing method: Comparison with coupled cluster including triples methods for BF, NO+, CN+, C2, BeO, NH3, CH2, H2O, BH, HF, SiH2, Li2, LiNa, LiBe+, NeH+, and O3

Garcı́a-Cuesta, I., Sánchez-Marı́n, J., Sánchez de Merás, A., Amor, N. Ben

Journal:

The Journal of Chemical Physics

Year:

1997

Language:

english

File:

PDF, 502 KB

english, 1997

50

Myocardial infarction in older than 75 years: An increasing population. CASTUO study

Fernández-Bergés, D., Félix-Redondo, F.J., Consuegra-Sánchez, L., Lozano-Mera, L., Miranda Díaz, I., Durán Guerrero, M., Benítez de Castro, F., Polanco García, J.B., López-Mínguez, J.R.

Journal:

Revista Clínica Española (English Edition)

Year:

2015

File:

PDF, 675 KB

2015