N. Parrinello: search on Z-Library

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51

Metadynamics

Alessandro Barducci, Massimiliano Bonomi, Michele Parrinello

Journal:

Wiley Interdisciplinary Reviews: Computational Molecular Science

Year:

2011

Language:

english

File:

PDF, 724 KB

english, 2011

52

Neurofibroma development in NF1 – insights into tumour initiation

Simona Parrinello, Alison C. Lloyd

Journal:

Trends in Cell Biology

Year:

2009

Language:

english

File:

PDF, 909 KB

english, 2009

53

IN MEMORIAM: PIERANGELO GAREGNANI

Sergio Parrinello

Journal:

Year:

2012

Language:

english

File:

PDF, 66 KB

english, 2012

54

Nuclear Quantum Effects in Solids Using a Colored-Noise Thermostat

Ceriotti, Michele, Bussi, Giovanni, Parrinello, Michele

Journal:

Physical Review Letters

Year:

2009

Language:

english

File:

PDF, 249 KB

english, 2009

55

Effect of N-Acetyl-Cysteine (NAC) Added to Fenoldopam or Dopamine on End-Tidal Carbon Dioxide and Mean Arterial Pressure at Time of Renal Artery Declamping During Cadaveric Kidney Transplantation

M. Sorbello, G. Morello, L. Parrinello, C. Molino, D. Rinzivillo, R. Pappalardo, M. Cutuli, D. Corona, P. Veroux, M. Veroux

Journal:

Transplantation Proceedings

Year:

2010

Language:

english

File:

PDF, 688 KB

english, 2010

56

Efficient and general algorithms for path integral Car–Parrinello molecular dynamics

Tuckerman, Mark E., Marx, Dominik, Klein, Michael L., Parrinello, Michele

Journal:

The Journal of Chemical Physics

Year:

1996

Language:

english

File:

PDF, 465 KB

english, 1996

57

Study of an F center in molten KCl

Parrinello, M., Rahman, A.

Journal:

The Journal of Chemical Physics

Year:

1984

Language:

english

File:

PDF, 712 KB

english, 1984

58

Structural and Electronic Properties of Amorphous Carbon

Galli, Giulia, Martin, Richard M., Car, Roberto, Parrinello, Michele

Journal:

Physical Review Letters

Year:

1989

Language:

english

File:

PDF, 191 KB

english, 1989

59

10.1038/17579

Marx, Dominik, Tuckerman, Mark E., Hutter, Jürg, Parrinello, Michele

Journal:

Year:

1999

Language:

english

File:

PDF, 475 KB

english, 1999

60

Motivation and anticipation in post-industrial tourism

Giuli Liebman Parrinello

Journal:

Annals of Tourism Research

Year:

1993

Language:

english

File:

PDF, 1.29 MB

english, 1993

61

The additive value of tirofiban administered with the high-dose bolus in the prevention of ischemic complications during high-risk coronary angioplasty: The advance trial

Marco Valgimigli, Gianfranco Percoco, Dario Barbieri, Fabrizio Ferrari, Gabriele Guardigli, Giovanni Parrinello, Olga Soukhomovskaia, Roberto Ferrari

Journal:

Journal of the American College of Cardiology

Year:

2004

Language:

english

File:

PDF, 105 KB

english, 2004

62

Persistence of the effects of attention and executive functions intensive rehabilitation in relapsing remitting multiple sclerosis

F. Mattioli, C. Stampatori, C. Scarpazza, G. Parrinello, R. Capra

Journal:

Multiple Sclerosis and Related Disorders

Year:

2012

Language:

english

File:

PDF, 157 KB

english, 2012

63

Improvements and Extensions to a Full-Potential Formulation Based on Independent Fields

Parrinello, A., Mantegazza, P.

Journal:

Year:

2012

Language:

english

File:

PDF, 982 KB

english, 2012

64

A Recipe for the Computation of the Free Energy Barrier and the Lowest Free Energy Path of Concerted Reactions †

Ensing, Bernd, Laio, Alessandro, Parrinello, Michele, Klein, Michael L.

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 657 KB

english, 2005

65

Simulation of structural phase transitions by metadynamics

Martoňák, Roman, Laio, Alessandro, Bernasconi, Marco, Ceriani, Chiara, Raiteri, Paolo, Zipoli, Federico, Parrinello, Michele

Journal:

Zeitschrift für Kristallographie

Year:

2005

Language:

english

File:

PDF, 436 KB

english, 2005

66

Canonical sampling through velocity rescaling

Bussi, Giovanni, Donadio, Davide, Parrinello, Michele

Journal:

The Journal of Chemical Physics

Year:

2007

Language:

english

File:

PDF, 455 KB

english, 2007

67

Efficient and Accurate Car-Parrinello-like Approach to Born-Oppenheimer Molecular Dynamics

Kühne, Thomas D., Krack, Matthias, Mohamed, Fawzi R., Parrinello, Michele

Journal:

Physical Review Letters

Year:

2007

Language:

english

File:

PDF, 254 KB

english, 2007

68

Synthesis of functionalized styrenes via palladium-catalyzed coupling of aryl bromides with vinyl tin reagents

McKean, D. R., Parrinello, G., Renaldo, A. F., Stille, J. K.

Journal:

Journal of Organic Chemistry

Year:

1987

Language:

english

File:

PDF, 378 KB

english, 1987

69

Colored-Noise Thermostats à la Carte

Ceriotti, Michele, Bussi, Giovanni, Parrinello, Michele

Journal:

Journal of Chemical Theory and Computation

Year:

2010

Language:

english

File:

PDF, 1.24 MB

english, 2010

70

Non-empirical assignment of the absolute configuration of (?)-naringenin, by coupling the exciton analysis of the circular dichroism spectrum and the ab initio calculation of the optical rotatory power

Giorgio, Egidio, Parrinello, Nunziatina, Caccamese, Salvatore, Rosini, Carlo

Journal:

Organic & Biomolecular Chemistry

Year:

2004

Language:

english

File:

PDF, 195 KB

english, 2004

71

Ecto- and endoparasite induce similar chemical and brain neurogenomic responses in the honey bee (Apis mellifera)

Cynthia M McDonnell, Cédric Alaux, Hugues Parrinello, Jean-Pierre Desvignes…

Journal:

Year:

2013

Language:

english

File:

PDF, 377 KB

english, 2013

72

Nuclear Analysis of an ITER Blanket Module

P. Chiovaro, P. A. Di Maio, V. Parrinello

Journal:

Journal of Fusion Energy

Year:

2013

Language:

english

File:

PDF, 703 KB

english, 2013

73

First Principles Study of Propene Polymerization in Ziegler−Natta Heterogeneous Catalysis

Boero, Mauro, Parrinello, Michele, Hüffer, Stephan, Weiss, Horst

Journal:

Journal of the American Chemical Society

Year:

2000

Language:

english

File:

PDF, 178 KB

english, 2000

74

Multifractal analysis and feature extraction in satellite imagery

Parrinello, T., Vaughan, R. A.

Journal:

International Journal of Remote Sensing

Year:

2002

Language:

english

File:

PDF, 1.55 MB

english, 2002

75

NOTE SULLA NOZIONE DI EQUILIBRIO NELL'ECONOMIA POLITICA

Sergio Parrinello

Journal:

Giornale degli Economisti e Annali di Economia (Nuova Serie)

Year:

1977

File:

PDF, 1.89 MB

1977

76

Metadynamics Simulations of the High-Pressure Phases of Silicon Employing a High-Dimensional Neural Network Potential

Behler, Jörg, Martoňák, Roman, Donadio, Davide, Parrinello, Michele

Journal:

Physical Review Letters

Year:

2008

Language:

english

File:

PDF, 1.02 MB

english, 2008

77

Controlling and Predicting Crystal Shapes: The Case of Urea

Salvalaglio, Matteo, Vetter, Thomas, Mazzotti, Marco, Parrinello, Michele

Journal:

Angewandte Chemie International Edition

Year:

2013

Language:

english

File:

PDF, 2.03 MB

english, 2013

78

Amorphous silicon studied by ab initio molecular dynamics: Preparation, structure, and properties

Štich, I., Car, R., Parrinello, M.

Journal:

Physical Review B

Year:

1991

Language:

english

File:

PDF, 573 KB

english, 1991

79

Proton transfer through the water gossamer

Hassanali, Ali, Giberti, Federico, Cuny, Jérôme, Kühne, Thomas D., Parrinello, Michele

Journal:

Proceedings of the National Academy of Sciences

Year:

2013

Language:

english

File:

PDF, 1.36 MB

english, 2013

80

Obesity and iron deficiency anemia as risk factors for asymptomatic bacteriuria

Cuttitta, F., Torres, D., Vogiatzis, D., Buttà, C., Bellanca, M., Gueli, D., Lupo, U., Schimmenti, C., Virzì, G., Petrantoni, R., Balistreri, F., Paterna, S., Parrinello, G.

Journal:

European Journal of Internal Medicine

Year:

2014

Language:

english

File:

PDF, 290 KB

english, 2014

81

Frictional effect in mode II delamination: Experimental test and numerical simulation

Parrinello, F., Marannano, G., Borino, G., Pasta, A.

Journal:

Engineering Fracture Mechanics

Year:

2013

Language:

english

File:

PDF, 1.82 MB

english, 2013

82

First Principles Molecular Dynamics Study of Ziegler−Natta Heterogeneous Catalysis

Boero, Mauro, Parrinello, Michele, Terakura, Kiyoyuki

Journal:

Journal of the American Chemical Society

Year:

1998

Language:

english

File:

PDF, 142 KB

english, 1998

83

Efficient stochastic thermostatting of path integral molecular dynamics

Ceriotti, Michele, Parrinello, Michele, Markland, Thomas E., Manolopoulos, David E.

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 495 KB

english, 2010

84

Langevin Equation with Colored Noise for Constant-Temperature Molecular Dynamics Simulations

Ceriotti, Michele, Bussi, Giovanni, Parrinello, Michele

Journal:

Physical Review Letters

Year:

2009

Language:

english

File:

PDF, 306 KB

english, 2009

85

Accurate sampling using Langevin dynamics

Bussi, Giovanni, Parrinello, Michele

Journal:

Physical Review E

Year:

2007

Language:

english

File:

PDF, 300 KB

english, 2007

86

Molecular Dynamics Study of the Solvation of Calcium Carbonate in Water

Bruneval, Fabien, Donadio, Davide, Parrinello, Michele

Journal:

Journal of Physical Chemistry B

Year:

2007

Language:

english

File:

PDF, 303 KB

english, 2007

87

Reaction of cyclic aminals with isocyanates

Parrinello, Giovanni, Muelhaupt, Rolf

Journal:

Journal of Organic Chemistry

Year:

1990

Language:

english

File:

PDF, 773 KB

english, 1990

88

Poor health-related quality of life and abnormal psychosocial adjustment in Italian children with perinatal HIV infection receiving highly active antiretroviral treatment

Bomba, Monica, Nacinovich, Renata, Oggiano, Silvia, Cassani, Morena, Baushi, Liliana, Bertulli, Cristina, Longhi, Daniela, Coppini, Simonetta, Parrinello, Giovanni, Plebani, Alessandro, Badolato, Raff

Journal:

Year:

2010

Language:

english

File:

PDF, 213 KB

english, 2010

89

Structure and Chemical Activity of Point Defects on MgCl 2 (001) Surface

Costuas, Karine, Parrinello, Michele

Journal:

Journal of Physical Chemistry B

Year:

2002

Language:

english

File:

PDF, 224 KB

english, 2002

90

A First Principles Exploration of a Variety of Active Surfaces and Catalytic Sites in Ziegler−Natta Heterogeneous Catalysis

Boero, Mauro, Parrinello, Michele, Weiss, Horst, Hüffer, Stephan

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 508 KB

english, 2001

91

α-gallium: A metallic molecular crystal

Gong, X. G., Chiarotti, Guido L., Parrinello, M., Tosatti, E.

Journal:

Physical Review B

Year:

1991

Language:

english

File:

PDF, 178 KB

english, 1991

92

Ab initio quality neural-network potential for sodium

Eshet, Hagai, Khaliullin, Rustam Z., Kühne, Thomas D., Behler, Jörg, Parrinello, Michele

Journal:

Physical Review B

Year:

2010

Language:

english

File:

PDF, 237 KB

english, 2010

93

Intensifying Platelet Inhibition With Tirofiban in Poor Responders to Aspirin, Clopidogrel, or Both Agents Undergoing Elective Coronary Intervention: Results From the Double-Blind, Prospective, Randomized Tailoring Treatment With Tirofiban in Patients Showing Resistance to Aspirin and/or Resistance to Clopidogrel Study

Valgimigli, M., Campo, G., de Cesare, N., Meliga, E., Vranckx, P., Furgieri, A., Angiolillo, D. J., Sabate, M., Hamon, M., Repetto, A., Colangelo, S., Brugaletta, S., Parrinello, G., Percoco, G., Ferr

Journal:

Year:

2009

Language:

english

File:

PDF, 547 KB

english, 2009

94

Electronic structure of the Cu, Zn superoxide dismutase active site and its interactions with the substrate

Carloni, Paolo, Bloechl, Peter E., Parrinello, Michele

Journal:

Journal of Physical Chemistry

Year:

1995

Language:

english

File:

PDF, 3.71 MB

english, 1995

95

Erratum: Asymptotic scaling and infrared behavior of the gluon propagator [Phys. Rev. D 60 , 094507 (1999)]

Leinweber, Derek B., Skullerud, Jon Ivar, Williams, Anthony G., Parrinello, Claudio

Journal:

Physical Review D

Year:

2000

Language:

english

File:

PDF, 210 KB

english, 2000

96

Conjugate gradient minimization of the energy functional: A new method for electronic structure calculation

Štich, I., Car, R., Parrinello, M., Baroni, S.

Journal:

Physical Review B

Year:

1989

Language:

english

File:

PDF, 470 KB

english, 1989

97

Si(111):Na: Structural and electronic properties from ab initio molecular dynamics

Moullet, Isabelle, Andreoni, Wanda, Parrinello, Michele

Journal:

Physical Review B

Year:

1992

Language:

english

File:

PDF, 246 KB

english, 1992

98

Stability and structural properties of the SC16 phase of ZnS under high pressure

Qteish, A., Parrinello, M.

Journal:

Physical Review B

Year:

2000

Language:

english

File:

PDF, 157 KB

english, 2000

99

and

Andreoni, Wanda, Giannozzi, Paolo, Parrinello, Michele

Journal:

Physical Review B

Year:

1995

Language:

english

File:

PDF, 1.41 MB

english, 1995

100

Phenomenological theory of first- and second-order metal-insulator transitions at absolute zero

March, N. H., Suzuki, M., Parrinello, M.

Journal:

Physical Review B

Year:

1979

Language:

english

File:

PDF, 201 KB

english, 1979

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