Sentence examples for computational explorations from inspiring English sources

Nowadays massive computation is required just to reduce and analyze experimental data, and simulations and computational explorations are employed in fields as diverse as climate modeling and research mathematics.

Computational explorations of dynamics of LeuT, DAT, and SERT showed that the isomerization to the inward-facing state induces a destabilization of the ion in the Na2 site.

ε was set to 0.1, and computational explorations showed that the precise value used was not critical to the results obtained.

Still, details about STX-PIP2 lipid interactions in a structural context of the full-length protein are missing despite the detailed experimental and computational explorations.

The computational explorations and linear stability analysis of the model suggest a reaction diffusion mechanism, which exhibits a short-range activation of Wnt plus a long-range inhibition with modulation of BMP signals in a growing tissue of cell lineage, can account for spontaneous formation of multiple crypts with the spatial and temporal pattern observed in experiments.

Furthermore, the challenges for future computational exploration in this field are discussed.

We aim at a systematic computational exploration of global and local SAR characteristics of compound data sets.

Subsequently, through methods of abduction, new vocabularies of form and potentials in performance are generated primarily through computational exploration.

However, if the computational exploration of the chemical space is limited by speed (i.e. throughput), a consensus fingerprint allows to outperform this consensus of scores.

This test can be useful as a check on mathematical models of periodic processes before spending efforts on a computational exploration of the solutions.

These studies show that the computational exploration of unknown chemical space is feasible, and new maps continue to be drawn at a variety of scales, even extending to a coarse mapping of the small molecule universe, akin to maps of the world and the visible night sky.