2013年第117卷40期
共38篇1. Saturation-recovery EPR with nitroxyl radical-Dy(III) spin pairs: distances and orientations. 11960-77页
作者:Donald J,Hirsh; Joselle,McCracken; Ryan,Biczo; Kelly-Ann,Gesuelli
2. Interaction of pristine and functionalized carbon nanotubes with lipid membranes. 12113-23页
作者:Svetlana,Baoukina; Luca,Monticelli; D Peter,Tieleman
3. Aqueous Mg2+ and Ca2+ ligand exchange mechanisms identified with 2DIR spectroscopy. 12268-75页
作者:Zheng,Sun; Wenkai,Zhang; Minbiao,Ji; Robert,Hartsock; Kelly J,Gaffney
4. The different interactions of lysine and arginine side chains with lipid membranes. 11906-20页
作者:Libo,Li; Igor,Vorobyov; Toby W,Allen
5. Effect of arm exchange on the liquid-solid transition of dense suspensions of star polymers. 12312-8页
作者:Fanny,Puaud; Taco,Nicolai; Lazhar,Benyahia; Erwan,Nicol
6. Calcium-α-L-guluronate complexes: Ca2+ binding modes from DFT-MD simulations. 12105-12页
作者:Wojciech,Plazinski; Mateusz,Drach
7. Protein photochromism observed by ultrafast vibrational spectroscopy. 11954-9页
作者:Andras,Lukacs; Allison,Haigney; Richard,Brust; Kiri,Addison; Michael,Towrie; Gregory M,Greetham; Garth A,Jones; Atsushi,Miyawaki; Peter J,Tonge; Stephen R,Meech
8. Molecular simulations of polycation-DNA binding exploring the effect of peptide chemistry and sequence in nuclear localization sequence based polycations. 11988-99页
作者:Robert M,Elder; Arthi,Jayaraman
9. Molecular dynamics simulations of human serum albumin and role of disulfide bonds. 11895-905页
作者:Maria Monica,Castellanos; Coray M,Colina
10. Dynamics of glass forming ammonia hydrates. 12157-63页
作者:H,Didzoleit; M,Storek; C,Gainaru; B,Geil; R,Böhmer
11. Proton transfer in wild-type GFP and S205V mutant is reduced by conformational changes of residues in the proton wire. 11921-31页
作者:Ron,Simkovitch; Amit,Huppert; Dan,Huppert; S James,Remington; Yifat,Miller
12. Multiscale simulation of the ground and photo-induced charge-separated states of a molecular triad in polar organic solvent: exploring the conformations, fluctuations, and free energy landscapes. 12065-75页
作者:D,Balamurugan; Adelia J A,Aquino; Francis,de Dios; Lionel,Flores; Hans,Lischka; Margaret S,Cheung
13. Direct observation of the low-spin Fe(III)-NO(radical) intermediate state during rebinding of NO to photodeligated ferric cytochrome c. 12039-50页
作者:Jaeheung,Park; Taegon,Lee; Manho,Lim
14. Dynamics of the formation of a charge transfer state in 1,2-bis(9-anthryl)acetylene in polar solvents: symmetry reduction with the participation of an intramolecular torsional coordinate. 12175-83页
作者:Luis,Gutiérrez-Arzaluz; Cesar A,Guarin; William,Rodríguez-Córdoba; Jorge,Peon
15. Revealing hidden helix propensity in Aβ peptides by molecular dynamics simulations. 12030-8页
作者:Christopher,Lockhart; Dmitri K,Klimov
16. Characteristic Raman optical activity signatures of protein β-sheets. 11943-53页
作者:Thomas,Weymuth; Markus,Reiher
17. Dynamics in glass forming sulfuric and nitric acid hydrates. 12164-74页
作者:M,Frey; H,Didzoleit; C,Gainaru; R,Böhmer
18. The charge transfer problem in density functional theory calculations of aqueously solvated molecules. 12189-201页
作者:Christine M,Isborn; Brendan D,Mar; Basile F E,Curchod; Ivano,Tavernelli; Todd J,Martínez
19. Aspects of ion hydration. Adiabatic compressibility compared to the dielectric properties of aqueous electrolyte solutions. 12252-60页
作者:Udo,Kaatze
20. Unique photophysical behavior of 2,2'-bipyridine-3,3'-diol in DMSO-water binary mixtures: potential application for fluorescence sensing of Zn2+ based on the inhibition of excited-state intramolecular double proton transfer. 12212-23页
作者:Sarthak,Mandal; Surajit,Ghosh; Chiranjib,Banerjee; Jagannath,Kuchlyan; Nilmoni,Sarkar
21. Number of free hydroxyl groups on bile acid phospholipids determines the fluidity and hydration of model membranes. 12135-44页
作者:Vedagopuram,Sreekanth; Avinash,Bajaj
22. Critical role of water in the binding of volatile anesthetics to proteins. 12007-12页
作者:Hai-Jing,Wang; Alfred,Kleinhammes; Pei,Tang; Yan,Xu; Yue,Wu
23. Partitioning of oleic acid into phosphatidylcholine membranes is amplified by strain. 12086-94页
作者:Mojca,Mally; Primož,Peterlin; Saša,Svetina
24. Well-tempered metadynamics as a tool for characterizing multi-component, crystalline molecular machines. 12286-95页
作者:Andrew J,Ilott; Sebastian,Palucha; Paul,Hodgkinson; Mark R,Wilson
25. Interaction of azole compounds with DOPC and DOPC/ergosterol bilayers by spin probe EPR spectroscopy: implications for antifungal activity. 11978-87页
作者:Francesca,Cicogna; Calogero,Pinzino; Sabrina,Castellano; Amalia,Porta; Claudia,Forte; Lucia,Calucci
26. Photoinduced charge transfer in solvated anthraquinones is facilitated by low-frequency ring deformations. 12276-85页
作者:Ajay,Jha; Debayan,Chakraborty; Varadharajan,Srinivasan; Jyotishman,Dasgupta
27. Superpressing of a room temperature ionic liquid, 1-ethyl-3-methylimidazolium tetrafluoroborate. 12296-302页
作者:Yukihiro,Yoshimura; Hiroshi,Abe; Takahiro,Takekiyo; Machiko,Shigemi; Nozomu,Hamaya; Ryoichi,Wada; Minoru,Kato
28. Polymer micelle assisted transport and delivery of model hydrophilic components inside a biological lipid vesicle: a coarse-grain simulation study. 12095-104页
作者:Goundla,Srinivas; Ram V,Mohan; Ajit D,Kelkar
29. Base pair sensitivity and enhanced ON/OFF ratios of DNA-binding: donor-acceptor-donor fluorophores. 12000-6页
作者:James N,Wilson; Jens,Wigenius; Demar R G,Pitter; Yanhua,Qiu; Maria,Abrahamsson; Fredrik,Westerlund
30. ESR and optical study of photo-orientation in azobenzene-containing liquid-crystalline polymer. 12328-38页
作者:Alexey V,Bogdanov; Andrey Kh,Vorobiev
31. Characterization of trans-2-[4-[(dimethylamino)styryl]benzothiazole as an ultrafast isomerization probe and a modifed Kramers theory analysis. 12224-33页
作者:Minako,Kondo; Xiang,Li; Mark,Maroncelli
32. The role of the crystallization temperature on the nanophase structure evolution of poly[(R)-3-hydroxybutyrate]. 12303-11页
作者:Maria Cristina,Righetti; Elpidio,Tombari; Maria Laura,Di Lorenzo
33. Interaction of dipalmitoyl phosphatidylcholine monolayers with a particle-laden subphase. 12124-34页
作者:Amir M,Farnoud; Jennifer,Fiegel
34. Revealing spectral features in two-photon absorption spectrum of Hoechst 33342: a combined experimental and quantum-chemical study. 12013-9页
作者:Joanna,Olesiak-Banska; Katarzyna,Matczyszyn; Robert,Zaleśny; N Arul,Murugan; Jacob,Kongsted; Hans,Ågren; Wojciech,Bartkowiak; Marek,Samoc
35. Expansion and internal friction in unfolded protein chain. 12059-64页
作者:U Mahammad,Yasin; Pulikallu,Sashi; Abani K,Bhuyan
36. On the characterization of inhomogeneity of the density distribution in supercritical fluids via molecular dynamics simulation and data mining analysis. 12184-8页
作者:Abdenacer,Idrissi; Ivan,Vyalov; Nikolaj,Georgi; Michael,Kiselev