검색결과 : 12건
| No. | Article |
|---|---|
| 1 |
Review: theoretical and experimental investigation of the intrinsic properties of Zn2GeO4 nanocrystals de Jesus JPA, Santos ACL, Pinto FM, Taft CA, La Porta FA Journal of Materials Science, 56(7), 4552, 2021 |
| 2 |
Energetics and Dynamics of Molecules, Solids, and Surfaces - QUITEL 2012 Taft CA Journal of Physical Chemistry A, 118(31), 5741, 2014 |
| 3 |
Use of virtual screening, flexible docking, and molecular interaction fields to design novel HMG-CoA reductase inhibitors for the treatment of hypercholesterolemia da Silva VB, Taft CA, Silva CHTP Journal of Physical Chemistry A, 112(10), 2007, 2008 |
| 4 |
Energetics and dynamics of molecules, solids and surfaces Taft CA Journal of Physical Chemistry A, 112(38), 8887, 2008 |
| 5 |
Molecular dynamics, density functional, ADMET predictions, virtual screening, and molecular interaction field studies for identification and evaluation of novel potential CDK2 inhibitors in cancer therapy da Silva VB, Kawano DF, Gomes AD, Carvalho I, Taft CA, da Silva CHTD Journal of Physical Chemistry A, 112(38), 8902, 2008 |
| 6 |
Different origins of green-light photoluminescence emission in structurally ordered and disordered powders of calcium molybdate Longo VM, de Figueiredo AT, Campos AB, Espinosa JWM, Hernandes AC, Taft CA, Sambrano JR, Varela JA, Longo E Journal of Physical Chemistry A, 112(38), 8920, 2008 |
| 7 |
The interaction of H-2, CO, CO2, H2O and NH3 on ZnO surfaces: an Oniom Study Martins JBL, Longo E, Salmon ODR, Espinoza VAA, Taft CA Chemical Physics Letters, 400(4-6), 481, 2004 |
| 8 |
Combined experimental and theoretical study to understand the photoluminescence of Sr1-xTiO3-x Orhan E, Pontes FM, Santos MA, Leite ER, Beltran A, Andres J, Boschi TM, Pizani PS, Varela JA, Taft CA, Longo E Journal of Physical Chemistry B, 108(26), 9221, 2004 |
| 9 |
An electron transfer mechanism of O-4 formation Pavao AC, Paula JCD, Custodio R, Taft CA Chemical Physics Letters, 370(5-6), 789, 2003 |
| 10 |
Ab initio and density functional study of the 5-pentacyclo[6.2.1.1(3,6).0(2,7).0(4,10)]dodecyl cation. A symmetrical mu-hydride bridged carbocation Carneiro JWD, Taft CA, Silva CHTDE, Tostes JGR, Seidl PR, Pinto PSD, Costa VEU, Alifantes J Chemical Physics Letters, 345(1-2), 189, 2001 |