Nowadays, the interest in the search for new nanomaterials with improved electrical, optical,
catalytic and biological properties has increased. Despite the potential benefits that can be …

Nanotechnology has brought great advances to many fields of modern science. A manifold
of applications of nanoparticles have been found due to their interesting optical, electrical …

There are many of pathogen parasite species with different susceptibility profile to
antiparasitic drugs. Unfortunately, almost QSAR models predict the biological activity of …

The neglected tropical diseases (NTDs) affect more than one billion people (one-sixth of the
world's population) and occur primarily in undeveloped countries in sub-Saharan Africa …

A complete design and screening system for environmental-friendly polychlorinated
naphthalene (PCN) derivatives was established through three-dimensional quantitative …

Background: Prior estimation of toxicity of each and every, existing and yet to be synthesized
chemicals is a must to elude their adverse effect on the environment. Experimental …

Highlights•CoMFA and CoMSIA approaches were successfully applied to predict toxicity of
substituted benzenes toward Tetrahymena pyriformis.•A simple and fairly good predictive …

We compare three methods for the selection of optimal subsets of molecular descriptors from
a much greater pool of such regression variables. On the one hand is our enhanced …

Tetrahymena pyriformis, due to the direct contact its cells have with the outside environment,
is attractive for assessing environmental toxicant effects. We report a quantitative structure …

Interspecies correlations allow the prediction of toxicity to a number of other species.
However, little attention has been paid to the theoretical considerations of the interspecies …