1 - 6 |
Gas-phase N-2 adsorption on mass-selected hydrogen-bonded cluster ions Fujihara A, Shimada A |
7 - 11 |
Adjusting dispersion parameters for the density-functional tight-binding description of molecular crystals Dolgonos GA, Boese AD |
12 - 21 |
Structure and dynamics properties of liquid ethylene glycol from molecular dynamics simulations Zhang N, Li MR, Zhang FS |
22 - 26 |
UV absorption spectra of trans-2-pentenal, trans-2-hexenal and 2-methyl-2-pentenal Kalalian C, Samir B, Roth E, Chakir A |
27 - 31 |
Application of IR spectra of two successive isotope labeled residues to the evaluation of dihedral angles of polyproline II structure Miyata D, Hiramatsu H, Nakabayashi T |
32 - 37 |
Geometry optimizations and evaluation of electronic properties of prism carbon tubes by density functional theory using plane waves Kodaya Y, Oki T, Yamakado H, Tokoyama H, Ohno K |
38 - 45 |
Discovery of novel indoleaminopyrimidine NIK inhibitors based on molecular docking-based support vector regression (SVR) model Ye Q, Li Q, Gao AH, Ying HZ, Cheng G, Chen J, Che JX, Li J, Dong XW, Zhou YB |
46 - 53 |
Electro-elastic modeling of thermal and mechanical properties of a spin crossover core/shell nanoparticle Affes K, Slimani A, Maalej A, Boukheddaden K |
54 - 62 |
Synthesis and photocatalytic activity of cubic cuprous oxide supported on activated carbon fibers Liu F, Liu Q, Liu Y, Xue RT, Li P, Fan XM |
63 - 68 |
First-principles molecular dynamics simulation of the ionic structure and electronic properties of Na(3)AlF(6 )molten salt Li J, Guo H, Zhang HL, Li TS, Gong Y |
69 - 73 |
Preparation, release and anticorrosion behavior of a multi-corrosion inhibitors-halloysite nanocomposite Xing XT, Xu XY, Wang JH, Hu WB |
74 - 79 |
Generalized Langevin analysis of inelastic X-ray scattering for copper/ethylene glycol nanofluid Yoshida K, Yamaguchi T |