Stability and isomerization of complexes formed by metal ions and cytosine isomers in aqueous phase

[1]  R. Kobayashi Correlated ab initio quantum chemical study of the interaction of the Na+, Mg2+, Ca2+, and Zn2+ ions with the tautomers of cytosine. , 2012, The journal of physical chemistry. A.

[2]  M. Rodgers,et al.  Tautomerization in the formation and collision-induced dissociation of alkali metal cation-cytosine complexes. , 2012, Physical chemistry chemical physics : PCCP.

[3]  G. Fogarasi,et al.  Tautomers of cytosine and their excited electronic states: a matrix isolation spectroscopic and quantum chemical study. , 2011, Physical chemistry chemical physics : PCCP.

[4]  M. Faubel,et al.  Ionization energies of aqueous nucleic acids: photoelectron spectroscopy of pyrimidine nucleosides and ab initio calculations. , 2009, Journal of the American Chemical Society.

[5]  J. Leszczynski,et al.  Ab initio kinetic simulation of gas-phase experiments: tautomerization of cytosine and guanine. , 2009, The journal of physical chemistry. B.

[6]  M. Vázquez,et al.  Theoretical study of cytosine-Al, cytosine-Cu and cytosine-Ag (neutral, anionic and cationic). , 2008, The journal of physical chemistry. A.

[7]  M. Vázquez,et al.  Ca, Cd, Zn, and their ions interacting with Cytosine: a theoretical study. , 2007, The journal of physical chemistry. A.

[8]  S. Grimme,et al.  How to compute isomerization energies of organic molecules with quantum chemical methods. , 2007, The Journal of organic chemistry.

[9]  Zhou Ruo Divalent Metal Ion-activated DNA Cleavage Activity of Copper Superoxide Dismutase , 2007 .

[10]  P. Hobza,et al.  Na+, Mg2+, and Zn2+ binding to all tautomers of adenine, cytosine, and thymine and the eight most stable keto/enol tautomers of guanine: a correlated ab initio quantum chemical study. , 2006, The journal of physical chemistry. B.

[11]  P. Hobza,et al.  Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solution. Part 4. Uracil and thymine. , 2005, Physical chemistry chemical physics : PCCP.

[12]  Pavel Hobza,et al.  Correlated ab Initio Study of Nucleic Acid Bases and Their Tautomers in the Gas Phase, in a Microhydrated Environment, and in Aqueous Solution. Part 3. Adenine , 2004 .

[13]  N. Russo,et al.  Gas-phase absolute Ca2+ and Mg2+ affinity for nucleic acid bases. A theoretical determination , 2003 .

[14]  F. Tureček,et al.  Hydrogen atom addition to cytosine, 1-methylcytosine, and cytosine-water complexes. a computational study of a mechanistic dichotomy , 2003 .

[15]  F. J. Luque,et al.  Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solutionDedicated to the memory of our friend and distinguished scientist Professor Peter Kollman. , 2002 .

[16]  Yutaka Watanabe,et al.  Relation of Hydrophobic Effect with Salt Effect: On the Viewpoint of Cluster Structure , 2002 .

[17]  N. Russo,et al.  Bond energies and attachments sites of sodium and potassium cations to DNA and RNA nucleic acid bases in the gas phase. , 2001, Journal of the American Chemical Society.

[18]  F. J. Luque,et al.  Perspective on “Electrostatic interactions of a solute with a continuum. A direct utilization of ab initio molecular potentials for the prevision of solvent effects” , 2000 .

[19]  J. Andrés,et al.  A theoretical study on cytosine tautomers in aqueous media by using continuum models , 2000 .

[20]  J. Leszczynski,et al.  A theoretical investigation of tautomeric equilibria and proton transfer in isolated and monohydrated cytosine and isocytosine molecules , 1999 .

[21]  R. Kobayashi A CCSD(T) STUDY OF THE RELATIVE STABILITIES OF CYTOSINE TAUTOMERS , 1998 .

[22]  J. Šponer,et al.  Interaction between the Guanine−Cytosine Watson−Crick DNA Base Pair and Hydrated Group IIa (Mg2+, Ca2+, Sr2+, Ba2+) and Group IIb (Zn2+, Cd2+, Hg2+) Metal Cations , 1998 .

[23]  C. Wesdemiotis,et al.  Li+, Na+, and K+ Binding to the DNA and RNA Nucleobases. Bond Energies and Attachment Sites from the Dissociation of Metal Ion-Bound Heterodimers , 1996 .

[24]  F. J. Luque,et al.  TAUTOMERISM AND PROTONATION OF GUANINE AND CYTOSINE. IMPLICATIONS IN THE FORMATION OF HYDROGEN-BONDED COMPLEXES , 1996 .

[25]  B. Johannsen Bioinorganic Chemistry: Inorganic Elements in the Chemistry of Life. An Introduction and Guide. , 1995 .

[26]  I. Gould,et al.  A theoretical study using ab initio methods of tautomerism in cytosine in the gas phase and in water , 1992 .

[27]  Parr,et al.  Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density. , 1988, Physical review. B, Condensed matter.

[28]  Wolfram Saenger,et al.  Principles of Nucleic Acid Structure , 1983 .

[29]  J. Tomasi,et al.  Electrostatic interaction of a solute with a continuum. A direct utilizaion of AB initio molecular potentials for the prevision of solvent effects , 1981 .

[30]  Franklin H. Portugal,et al.  A century of DNA. A history of the discovery of the structure and function of the genetic substance , 1979, Medical History.

[31]  M. Dreyfus,et al.  Tautomerism in cytosine and 3-methylcytosine. A thermodynamic and kinetic study. , 1976, Journal of the American Chemical Society.

[32]  P. Mezey,et al.  A note on a non-empirical molecular orbital study of some cytosine and thymine tautomers , 1975 .

[33]  M. Plesset,et al.  Note on an Approximation Treatment for Many-Electron Systems , 1934 .