Caffeine interactions with nucleic acids. Molecular mechanics calculations of model systems for explanation of mechanisms of biological actions

Theoretical Chemistry Accounts

Volumn 110, Issue 6, 2003, Pages 466-472

  Poltev, V I ^a,b   Grokhlina, T I ^c   Deriabina, A ^a   Gonzalez E ^a  

^a BENEMÉRITA UNIVERSIDAD AUTÓNOMA DE PUEBLA   (Mexico)

^b INSTITUTE OF THEORETICAL AND EXPERIMENTAL BIOPHYSICS   (Russian Federation)

^c INSTITUTE OF MATHEMATICAL PROBLEMS OF BIOLOGY   (Russian Federation)

Author keywords

Caffeine; DNA interactions; Energy calculations; Molecular mechanics

Indexed keywords

CAFFEINE; DNA; DOUBLE STRANDED DNA; NUCLEIC ACID BASE;

BASE PAIRING; CALCULATION; CONFERENCE PAPER; DRUG DNA INTERACTION; HYDROGEN BOND; MODEL; MOLECULAR DYNAMICS; STRUCTURE ANALYSIS;

EID: 0347090486     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-003-0503-x     Document Type: Conference Paper

References (22)

1. Brice CF, Smith AP (2002) Int J Food Sci Nutr 53:55
2. Brauer LH, Buican B, De Wit H (2002) Behav Pharmacol 5:111
3. Nurminen ML, Niittynen L, Korpela R, Vapaatalo H (1999) Eur J Clin Nutr 53:831
4. Hixon SC, Yielding KL (1976) Mutat Res 34:195
5. Wolf K, Kaudewitz F (1976) Mol Gen Genet 146:89
6. Eberhard C, Herrmann RL (1972) J Bacteriol 112:224
7. Selby CP, Sancar A (1991) Biochemistry 30:3841
8. Traganos F, Kapuscinsky J, Darzynkiewicz Z (1991) Cancer Res 51:3682
9. Selby CP, Sancar A (1990) Proc Natl Acad Sci USA 87:3522
10. Tempel K, von Zallinger C (1997) Z Naturforsch C 52:466
11. Piosik J, Zdunek M, Kapuscinski J (2002) Biochem Pharmacol 63:635
12. Larsen RW, Jasuja R, Hetzler RK, Muraoka PT, Andrada VG, Jameson DM (1996) Biophys J 70:443
13. Davies DB, Veselkov DA, Evstigneev MP, Veselkov AN (2001) J Chem Soc Perk Trans 2:61
14. Davies DB, Veselkov DA, Djimant LN, Veselkov AN (2001) Eur Biophys J 30:354
15. Poltev VI, Shulyupina NV (1986) J Biomol Struct Dyn 4:739
16. Poltev VI, Deriabina AS, Gonzalez E, Grokhlina TI (2002) Biophysics 47:972
17. Sutor DG (1958) Acta Crystallogr 11:453
18. Low-Sing Kan, Borer PhN, Cheng DM, Ts'o POP (1980) Biopolymers 19:1641
19. Fritzsche H, Petri I, Schutz H, Weller K, Sedmera R, Lang H (1980) Biophys Chem 11:109
20. Fritzsche H, Lang H, Sprinz H, Pohle W (1980) Biophys Chem 11:121
21. Falk M, Chew W, Walter JA, Kwiatkowski W, Barclay KD, and Klassen GA (1998) Can J Chem 76:48
22. Danilov VI, Slyusarchuk ON, Poltev VI, Alderfer JL, Wollman RM, Brickmann JA, Lautenschlager P (1992) J Biomol Struct Dyn 9:1239