G. Buemi

发表

An improved quantum-mechanical study of environmental effects on the spectral shift of the rhodopsin system

A. Raudino, F. Zuccarello, G. Buemi, 1983 .

Theoretical study of malonamide and nitromalonamide in vacuum and in water solution

F. Zuccarello, G. Buemi, 2005 .

Barbituric and thiobarbituric acids: a conformational and spectroscopic study.

F. Zuccarello, A. Contino, G. Buemi, 2003, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Ab initio DFT study of the rotation barriers and competitive hydrogen bond energies (in gas phase and water solution) of 2-nitroresorcinol, 4,6-dinitroresorcinol and 2-nitrophenol in their neutral and deprotonated conformations

G. Buemi, 2002 .

Molecular conformation of cyclenes: IV. Cyclononadienes

F. Zuccarello, G. Buemi, G. Favini, 1971 .

Molecular conformation of cyclenes: III. trans-cyclooctene, trans-cyclononene, cis- and trans-cyclo-decene

F. Zuccarello, G. Buemi, G. Favini, 1970 .

DFT study of the intramolecular hydrogen bonds in the amino and nitro-derivatives of malonaldehyde

F. Zuccarello, G. Buemi, 2004 .

Is the intramolecular hydrogen bond energy valuable from internal rotation barriers

F. Zuccarello, G. Buemi, 2002 .

Molecular conformation of cyclenes: Part IX. Asymmetrical 1,3,6-cyclononatriene and 1,3,6-cyclodecatriene

A. Raudino, F. Zuccarello, D. Grasso, 1977 .

Molecular orbitals and ionization potentials of pentatomic heterocyclic-system benzoderivatives

G. Romeo, F. Zuccarello, G. Buemi, 1983 .

Conformational and Spectroscopic Study of Acrylic Acid Derivatives

A. Raudino, F. Zuccarello, D. Grasso, 1982 .

Molecular conformations and rotation barriers of 2-halogenoethanethiols and 2-halogenoethanols: an ab initio study

G. Buemi, 1994 .

THERMAL-EXPANSION AND COMPRESSIBILITY COEFFICIENTS OF PHOSPHOLIPID-VESICLES - EXPERIMENTAL-DETERMINATION AND THEORETICAL MODELING

A. Raudino, F. Zuccarello, C. L. Rosa, 1990 .

Ab initio and DFT studies on conformations, hydrogen bonding and electronic structures of glyoxalmonoxime and its methyl derivatives

P. Venuvanalingam, M. Ramalingam, G. Buemi, 2004 .

Ab initio DFT study of the hydrogen bridges in hexafluoro-acetylacetone, trifluoro-acetylacetone and some 3-substituted derivatives

G. Buemi, 2000 .

Ab initio study of tautomerism and hydrogen bonding of β-carbonylamine in the gas phase and in water solution

P. Venuvanalingam, F. Zuccarello, M. Ramalingam, 2000 .

Ab Initio Study of Formazan and 3-Nitroformazan

S. C. Ammal, P. Venuvanalingam, F. Zuccarello, 1998 .

Molecular conformations and intramolecular hydrogen bonding of 3-formylmalondialdehyde and 3-formylacetylacetone. An ab initio study

F. Zuccarello, G. Buemi, 1997 .

AM1 study of tautomerism and intramolecular hydrogen bonding in thiomalondialdehyde and thioacetylacetone

G. Buemi, 1990 .

Malondialdehyde and acetylacetone. An AM1 study of their molecular structures and keto–enol tautomerism

G. Buemi, C. Gandolfo, 1989 .

Computational note on acetylacetone IR spectrum

G. Buemi, 2007 .

Spectroscopic CNDO/CI study of some cyclic polyenes

A. Raudino, F. Zuccarello, G. Buemi, 1980 .

Molecular conformation of cyclenes. I. Cyclohexene, cycloheptene, cis- and trans-cyclooctene, cis- and trans-cyclononene

G. Buemi, G. Favini, M. Raimondi, 1968 .

Conformational energies of cyclenes

F. Zuccarello, G. Buemi, G. Favini, 1973 .

Cycloadditions of mesitonitrile oxide with amino- and nitrostilbenes

A. Rescifina, A. Corsaro, V. Pistarà, 2000 .

The role of the hydrogen bonding in cycloadditions of benzonitrile oxide with cyanophenols

R. Romeo, A. Corsaro, G. Perrini, 1996 .

Stereoselective synthesis of fused γ-lactams by intramolecular nitrone cycloaddition

A. Rescifina, R. Romeo, A. Procopio, 1994 .

AM1 study of tautomerism and intramolecular hydrogen bonding in thiomalondialdehyde and thioacetylacetone

G. Buemi, 1990 .

Keto–enol tautomerism of dithiomalondialdehyde and dithioacetylacetone. A reinvestigation using version 2.1 of the AM1 method

G. Buemi, 1990 .

Intramolecular Hydrogen Bonds. Methodologies and Strategies for Their Strength Evaluation

G. Buemi, 2006 .

Ab initio study of the thioketo-enethiol tautomerism of dithiomalondialdehyde and dithioacetylacetone

G. Buemi, 1992 .

Keto‐Enol Tautomerism of Dithiomalondialdehyde and Dithioacetylacetone. A Reinvestigation Using Version 2.1 of the AM1 Method.

G. Buemi, 1991 .

Molecular and Electronic Structures of Thieno[3,4-b]thiophene-2-carboxylic Acid and Acetic Thieno[3,4-b]thiophene-2-carboxylic Anhydride. An AM1, MNDO, and CNDO/S Study

G. Buemi, 1989 .

AM1 study of intramolecular hydrogen bonding in the dithio analogues of malondialdehyde and acetylacetone

G. Buemi, 1989 .

Conformational study of cyclic polysulphides

A. Raudino, F. Zuccarello, G. Buemi, 1988 .

Molecular conformation of cyclenes. II. cyclohexadienes, cycloheptadienes and cyclooctadienes

F. Zuccarello, G. Buemi, G. Favini, 1969 .

Phase transitions and structural studies ofp-n-alkoxybenzyliden-p’-fluoro-anilines

D. Grasso, G. Buemi, C. Gandolfo, 1988 .

Electronic spectra and excited state dipole moments of heterocyclic pentaatomic systems and their benzo and dibenzo derivatives

G. Romeo, F. Zuccarello, G. Buemi, 1983 .

Conformational Study of Cyclic Polysulfides. Part 1. Pentathiepins

A. Raudino, F. Zuccarello, G. Buemi, 1988 .

Self-consistent reaction field calculations of the solvent effect on absorption and emission n, π* transitions of diazines

A. Raudino, F. Zuccarello, G. Buemi, 1984 .

A critical analysis of the nature of the MOs and electronic transitions in fluorene, indene and some isoelectronic benzene derivatives

A. Raudino, F. Zuccarello, G. Buemi, 1982 .

Configuration Analysis and Electronic State Properties. III. Ten-π-electron Systems

G. Buemi, 1980 .

Configuration analysis and electronic states properties

G. Buemi, G. Favini, 1972 .

An MNDOC study of 2,3-diazabicyclo[2.2.1]heptene and 2,3-diazabicyclo[2.2.2]octene

F. Zuccarello, G. Buemi, 1986 .

Basis set effects on the energy of intramolecular O–H⋯halogen hydrogen bridges in ortho-halophenols and 2,4-dihalo-malonaldehyde

G. Buemi, 2004 .

Ab initio study of 2,4-dihalosubstituted malonaldehyde and 2-halo-phenols in gas phase and solution

G. Buemi, 2002 .

Hydrogen bonding and rotation barriers: A comparison between MNDO and AM1 results

A. Raudino, F. Zuccarello, G. Buemi, 1988 .

Electronic structure, UV spectra and reactivity of non-benzenoid systems by the INDO/S-CI method: Part II. Methylenecyclopropene and its derivatives

A. Raudino, F. Zuccarello, G. Buemi, 1981 .

Ab initio study of the potential-energy well of malondialdehyde on varying the O⋯O distance

F. Zuccarello, G. Buemi, 1996 .

Molecular conformation of cyclenes: Part VIII. Eight-, nine-, and ten-membered cyclotetraenes

F. Zuccarello, D. Grasso, G. Buemi, 1979 .

Functionalized g-Lactones via Intramolecular Nitrile Oxide Cycloaddition

A. Rescifina, A. Corsaro, N. Uccella, 1993 .

Electronic structure, UV spectra and reactivity of nonbenzenoid systems by the INDO/S-CI method: Part I. Fulvenes, heptafulvenes, benzofulvenes and fulvalenes

A. Raudino, F. Zuccarello, G. Buemi, 1981 .

An approach to the ionic cholinergic interaction. Theoretical treatment of the interaction between tetramethylammonium and acetate ions

A. Raudino, F. Zuccarello, G. Buemi, 1980 .

DFT study of the hydrogen bond strength and IR spectra of formic, oxalic, glyoxylic and pyruvic acids in vacuum, acetone and water solution

Giuseppe Buemi, G. Buemi, 2009 .

Conformational equilibria of 2-substituted 1,3-dithio-5,6-benzocycloheptene and 1,3-dioxa-5,6-benzocycloheptene

F. Zuccarello, G. Buemi, 1995 .

Importance of steric effect on the hydrogen bond strength of malondialdehyde and acetylacetone 3‐substituted derivatives. An ab initio study

F. Zuccarello, G. Buemi, 1997 .

A theoretical study of d-glucose, d-galactose, and parent molecules: solvent effect on conformational stabilities and rotational motions of exocyclic groups

F. Zuccarello, G. Buemi, 1995 .

Conformations and electronic structure of dithiin, 1,4-dithiino[2,3-c;6,5-c jdiisothiazole and its derivatives

G. Buemi, C. Gandolfo, 1989 .

Theoretical Study of Proton and Solvent Effects on Molecular Stacking

C. Rigano, A. Raudino, F. Zuccarello, 1983 .

A theoretical study of ion pairs in aqueous solution. Binding of cholinergic neurotransmitters to the anionic sites of synaptic receptors

A. Raudino, F. Zuccarello, G. Buemi, 1982 .

Effect of the conformation of the hydrophobic long chains on ionic association in aqueous solution. Theoretical study of the poly(methyleneammonium) acetate system

A. Raudino, F. Zuccarello, G. Buemi, 1981 .

The Polarizable Continuum Potential Model in the Liquid State Calculations. Density Functional Computational Analysis of the Anharmonic Vibrational Spectrum of Liquid Water

R. Cataliotti, G. Buemi, 2021 .

Atomic orbitals in the ab initio analysis of imidazole H-bonding

G. Re, F. Zuccarello, G. Buemi, 1988 .

Molecular conformation of cyclenes: Part VI. Cycloalkatrienes with seven to ten carbon atoms in the ring

F. Zuccarello, D. Grasso, G. Buemi, 1977 .

CONFORMATIONAL ANALYSIS OF ETHANE-1,2-DITHIOL AND MERCAPTOETHANOL AN AB INITIO SCF HF/3-21G∗ AND 6-31G∗∗ STUDY

G. Buemi, 1993 .

Intramolecular hydrogen bonding of malondialdehyde and its monothio and dithio analogues studied by the PM3 method

G. Buemi, 1990 .

Conformational analysis and rotation barriers of 2‐aminoethanethiol and 2‐aminoethanol: An ab initio study

G. Buemi, 1996 .