Now showing items 1-10 of 15005
Current trends in molecular modeling methods applied to the study of cyclodextrin complexes
In this review the authors present an overview of different molecular modeling campaigns dealing with the study and characterization of cyclodextrins (CDs) inclusion complexes with applicability to diverse biomedical and ...
Desenvolvimento da microscopia de força química usando modelagem molecular
(Universidade Federal de São CarlosBRUFSCarPrograma de Pós-Graduação em Ciência dos Materiais - PPGCM-So, 2013-03-19)
In this work was developed a prototype of a new nanobiosensor with molecular specificity through a study of theoretical models of Chemical Force Microscope. For the sensing were used molecular modeling techniques as well ...
A MOLECULAR MODEL POTENTIAL STUDY OF MOLECULAR WIRES: I SIMPLE LINEAR CHAIN
(Sociedad Chilena de Química, 2007)
Minimal Molecular Models for the Study of Nanostructures
(AMER SCIENTIFIC PUBLISHERS, 2009-06)
The existence of a minimal molecular model to represent some electronic properties of nanostructures is analyzed for several kinds of nanotubes and graphene surfaces by using the Extended Hückel Theory. It is shown that ...
Experimental approaches and computational modeling of rat serum albumin and its interaction with piperine
The bioactive piperine (1-piperoyl piperidine) compound found in some pepper species (Piper nigrum linn and Piper sarmentosum Roxb) has been shown to have therapeutic properties and to be useful for well-being. The tests ...
Modeling and molecular dynamics indicate that snake venom phospholipase B-like enzymes are Ntn-hydrolases
Phospholipase-B-like (SVPLB-like) enzymes are present in relatively small amounts in a number of venoms, however, their biological function and mechanisms of action are un-clear. A three-dimensional model of the SVPLB-like ...