Sentence examples for modeling calculation is from inspiring English sources

The energies from molecular modeling calculation is less in [Ni2(OBH)Cl4]·H2O·Ethanthosethose for [Co(OBH 2Cl]Cl·½EtOH indicating that the presence of two metals stabilized the complex more than the mono metal.

Due to the paucity of cross-links between Mediator and pol II, and because a cryo-EM map at sufficient resolution for molecular modeling was only available for Mediator without pol II, modeling calculations were performed for Mediator alone.

Molecular modeling calculations were performed to prove the reliability of the proposed electrodes.

The molecular modeling calculations were performed in vacuum phase by means of VAMP module available in Material Studio 4.0 package.

This represents the exact process that the operator will face, and all detailed modeling calculations are working behind this interface.

Molecular modeling calculations were used to foresee the better stoichiometry of the complex formed as well as the possible orientations of PZQ inside the β-CD cavity.

In this paper a series of molecular modeling calculations were conducted on various fluorine substituted polymers in order to predict their densities.

A series of shock-tube experiments and chemical kinetics modeling calculations were performed to investigate the ignition behavior of methane and ethane with oxygen in regions which are not presently well understood and in a much more comprehensive manner than what has been done previously.

All the pharmacophore modeling calculations were carried out by using HypoGen method implemented in DS2.5 software.

All modeling calculations were performed using PMOD image analysis software, version 3.3 (PMOD Technologies Ltd ,Zurich, Switzerland; www.pmod.com).

Steps 1 and 2 are in the input stage, and step 3 to 7 belong to the modeling calculation that is controlled by the operator.