The triplex forming ability of nonnatural nucleobases: A computational approach

Journal of Molecular Structure: THEOCHEM

Volumn 496, Issue 1-3, 2000, Pages 101-105

  Fenyo R ^a   Timar Z ^a   Palinko I ^b   Penke, B ^a,b  

^a UNIVERSITY OF SZEGED   (Hungary)

^b UNIVERSITY OF SZEGED   (Hungary)

Author keywords

Geometric data; H bond energies; Semiempirical methods; Triplet forming nucleobases

Indexed keywords

2 AMINOPYRROLE; ADENINE; CYTOSINE; DNA; GUANINE; INDOL 2 YLAMINE; NUCLEIC ACID BASE; PYRIDIN 2 YLAMINE; QUINOLIN 2 YLAMINE; THYMINE; UNCLASSIFIED DRUG;

ARTICLE; COMPUTER ANALYSIS; COMPUTER PROGRAM; ENERGY; HYDROGEN BOND; NUCLEIC ACID STRUCTURE; QUANTUM CHEMISTRY;

EID: 0343986401     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(99)00171-2     Document Type: Article

References (10)

1. Thuong N.T., Hélène C. Angew. Chem. Int. Ed. 32:1993;666.
2. Kool E.T. Chem. Rev. 97:1997;1473.
3. Griffin L.C., Kiesling L.L., Beal P.A., Gillespie P., Dervan P.B. J. Am. Chem. Soc. 114:1992;7976.
4. INSIGHT II (release 97.0), Molecular Simulations Inc., 9685 Scranton Road, San Diego, CA, USA.
5. Dewar M.J.S., Thiel W. J. Am. Chem. Soc. 99:1977;4899.
6. Stewart J.J.P. J. Comput. Chem. 10:1989;209. see also p. 221.
7. SPARTAN 4.1.1 (SGI version) Wavefunction, Inc., 18401 von Karman Ave. #370, Irvine, CA 92715 USA.
8. Watson J.D., Crick F.H.C. Nature. 171:1953;737.
9. Hoogsteen K. Acta Cryst. 12:1959;822.
10. Cassidy S.A., Slickers P., Trent J.O., Capaldi D.C., Roselt P.D., Reese C.B., Neidle S., Fox K.R. Nucleic Acids Research. 25:1997;4891.