Izbrana bibliografija v letu <strong>2005</strong> Selected Bibliography in Year <strong>2005</strong> 8. DOLENC, Jo`ica, BOR[TNIK, Urban, HODO[^EK, Milan, KOLLER, Jo`e, JANE@I^, Du{anka. An ab initio QM/MM study of the conformational stability of complexes formed by netropsin and DNA. The importance of van der Waals interactions and hydrogen bonding. J. Mol. Struct., Theochem, <strong>2005</strong>, vol. 718, no. 1/3, str. 77-85. ¢COBISS.SI-ID 3161370¥ 9. GRDADOLNIK, Jo`e, MARÉCHAL, Yves. Hydrogen-deuterium exchange in bovine serum albumin monitored by Fourier transform infrared spectroscopy. Part I, Structural studies. Appl. Spectrosc., <strong>2005</strong>, vol. 59, no. 11, str. 41-50. ¢COBISS.SI-ID 3342362¥ 10. GRDADOLNIK, Jo`e, MARÉCHAL, Yves. Hydrogen-deuterium exchange in bovine serum albumin monitored by Fourier transform infrared spectroscopy. Part II, Kinetic studies. Appl. Spectrosc., <strong>2005</strong>, vol. 59, no. 11, str. 51-80. ¢COBISS.SI-ID 3342618¥ 11. HUETZ, Philippe, MAVADDAT, Nasim, MAVRI, Janez. Reaction between ellagic acid and an ultimate carcinogen. J. Chem. Inf. Mod., <strong>2005</strong>, vol. 45, no. 6, str. 1564-1570. ¢COBISS.SI-ID 3386906¥ 12. JANE@I^, Du{anka, PENCA, Matej, POLJANEC, Ksenija, HODO[^EK, Milan. Computer simulation studies of molecular systems and their reactions. Lect. Ser. Comput. Computat. Sci., <strong>2005</strong>, vol. 4B, str. ¢1589¥-1592. ¢COBISS.SI-ID 3391258¥ 13. JANE@I^, Du{anka, PRAPROTNIK, Matej, MERZEL, Franci. Molecular dynamics integration and molecular vibrational theory. I, New symplectic integrators. J. Chem. Phys., <strong>2005</strong>, vol. 122, no. 17, art. no. 174101 (14 str.). ¢COBISS.SI-ID 3208474¥ 14. JEV[EVAR, Simona, GABERC-POREKAR, Vladka, FONDA, Irena, PODOBNIK, Barbara, GRDADOLNIK, Jo`e, MENART, Viktor. Production of nonclassical inclusion bodies from which correctly folded protein can be extracted. Biotechnol. Prog., <strong>2005</strong>, vol. 21, no. 2, str. 632- 639. ¢COBISS.SI-ID 3212058¥ 15. JOVANOVSKI, Vasko, OREL, Boris, JE[E, Robi, [URCA VUK, Angela, MALI, Gregor, HO^EVAR, Samo B., GRDADOLNIK, Jo`e, STATHATOS, Elias, LIANOS, Panagiotis. Novel 180 polysilsesquioxane-I- - /I ionic electrolyte for dye-sensitized photoelectrochemical cells. J. Phys. 3 Chem., B, Condens. Mater. Surf. Interfaces Biophys., <strong>2005</strong>, vol. 109, no. 30, str. 14387- 14395. ¢COBISS.SI-ID 3319834¥ 16. KAPOU, Agnes, FOUSTERIS, Manolis A., NIKOLAROPOULOS, Sotiris S., ZERVOU, Maria, GOLI^ GRDADOLNIK, Simona, ZOUMPOULAKIS, Panagiotis, KYRIKOU, Ioanna, MAVROMOUSTAKOS, Thomas. 2D NMR and conformational analysis of a prototype anti-tumour steroidal ester. J. Pharm. Biomed. Anal., <strong>2005</strong>, vol. 38, no. 3, str. 428-434. ¢COBISS.SI-ID 3279898¥ 17. KOVA^I^, Sa{a, LESAR, Antonija, HODO[^EK, Milan. Density functional characterization of the potential energy surface of the NO 2 + Br reaction. Chem. Phys. Lett., <strong>2005</strong>, vol. 413, str. 36-41. ¢COBISS.SI-ID 19324455¥
Izbrana bibliografija v letu <strong>2005</strong> Selected Bibliography in Year <strong>2005</strong> 18. KOVA^I^, Sa{a, LESAR, Antonija, HODO[^EK, Milan. Quantum mechanical study of the potential energy surface of the ClO + NO 2 reaction. J. Chem. Inf. Mod., <strong>2005</strong>, vol. 45, str. 58-64. ¢COBISS.SI-ID 18812967¥ 19. KRISTAN, Katja, KRAJNC, Katja, KONC, Janez, GOBEC, Stanislav, STOJAN, Jure, LANI[NIK- RI@NER, Tea. Phytoestrogens as inibitors of fungal 17ß-hydroxysteroid dehydrogenase. Steroids, <strong>2005</strong>, vol. 70, str. 626-635. ¢COBISS.SI-ID 19811033¥ 20. KURE^I^, Manja, SFILIGOJ-SMOLE, Majda, GRDADOLNIK, Jo`e. [tudij strukturnih sprememb polietilen-tereftalatnih vlaken z ramansko spektroskopijo. Tekstilec, <strong>2005</strong>, letn. 48, {t. 7/9, str. 167-172. ¢COBISS.SI-ID 10073878¥ 21. LESAR, Antonija, KOVA^I^, Sa{a, HODO[^EK, Milan, MÜHLHÄUSER, Max, PEYERIMHOFF, Sigrid. Electronic spectrum and photodissociation of CIONO in comparison to BrONO. J. Phys. Chem., A, Mol. Spectrosc. Kinet. Environ. Gen. Theory, <strong>2005</strong>, vol. 109, str. 10357- 10362. ¢COBISS.SI-ID 19565351¥ 22. LESAR, Antonija, KOVA^I^, Sa{a, HODO[^EK, Milan, STADLER, Margret, MÜHLHÄUSER, Max, PEYERIMHOFF, Sigrid. Low-lying exiceted states and photodissociation studies of cis- BrONO. Mol. Phys., <strong>2005</strong>, vol. 103, str. 2375-2380. ¢COBISS.SI-ID 19166247¥ 23. MERZEL, Franci, SMITH, Jeremy C. High-density hydration layer of lysozymes : molecular dynamics decomposition of solution scattering data. J. Chem. Inf. Mod., <strong>2005</strong>, vol. 45, no. 6, str. 1593-1599. ¢COBISS.SI-ID 3365402¥ 24. OBLAK, Marko, GOLI^ GRDADOLNIK, Simona, KOTNIK, Miha, JERALA, Roman, FILIPI^, Metka, [OLMAJER, Toma`. In silico fragment-based discovery of indolin-2-one analogues as potent DNA gyrase inhibitors. Bioorg. Med. Chem. Lett., <strong>2005</strong>, vol. 15, no. 23, str. 5207-5210. ¢COBISS.SI-ID 3372826¥ 25. OREL, Boris, JE[E, Robi, LAVREN^I^ [TANGAR, Ur{ka, GRDADOLNIK, Jo`e, PUCHBERGER, Michael. Infrared attenuated total reflection spectroscopy studies of aprotic condensation of (EtO) 3 Si-R-Si(OEt) 3 and R-Si(OEt) 3 systems with carboxylic acids. J. Non-Cryst. Solids, <strong>2005</strong>, vol. 351, str. 530-549. ¢COBISS.SI-ID 389115¥ 26. PRAPROTNIK, Matej, DELLE SITE, Luigi, KREMER, Kurt. Adaptive resolution molecular-dynamics simulation : changing the degrees of freedom on the fly. J. Chem. Phys., <strong>2005</strong>, vol. 123, no. 22, 224106 (14 str.). ¢COBISS.SI-ID 3399450¥ 27. PRAPROTNIK, Matej, JANE@I^, Du{anka. Molecular dynamics integration and molecular vibrational theory. II, Simulation of non-linear molecules. J. Chem. Phys., <strong>2005</strong>, vol. 122, no. 17, art. no. 174102 (9 str.). ¢COBISS.SI-ID 3208730¥ 28. PRAPROTNIK, Matej, JANE@I^, Du{anka. Molecular dynamics integration and molecular vibrational theory. III, The IR spectrum of water. J. Chem. Phys., <strong>2005</strong>, vol. 122, no. 17, art. no. 174103 (10 str.). ¢COBISS.SI-ID 3208986¥ 181
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