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For each of the top 20,000 compounds ranked by AutoDock 4.0 score, the top three docked complexes were minimized with 200 steps of the adopted basis Newton-Raphson method using CHARMM [60] with the MMFF force field [63] and a distance-dependent dielectric solvent term (ε = 4).
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Step 5. Finally, select the minimum one returned by the above two steps to be the adopted length of the next sampling interval, i.e., h=min{h 1,h 2}, which avoids omitting critical points.
The steps of the test were adopted according to the United States Pharmacopoeia [17] procedure.
The steps of the test were adopted according to the USP [4] procedures.
This constructive heuristic is similar to the first steps of the procedure currently adopted at the terminal to plan vehicle routes.
Several steps of analysis were adopted to evaluate the sand bodies of the area under investigation.
We used the Replica path (RPATh) method to divide the system into 16 structures equidistantly apart in the RMSD space between the reactants and products and minimized each obtained structure using 3000 steps of adopted basis Newton Raphson (ABNR) minimization.
Nevertheless, in the course of time the women took the brave steps of adopting these new ideas and proving whether they were beneficial to them or not.
They were one of the first steps in the fulfillment of the recently adopted Eight-Eight Fleet Program that required a fleet of eight dreadnoughts and armored cruisers.
The power of this approach is illustrated, step-by-step, with the determination of the structure adopted by a potential G-quadruplex sequence found in the 5′-untranslated region of the cAMP responsive element modulator (CREM) mRNA.
The weekend meal reduction appears to be out of step with the standards adopted by the American Correctional Association.
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Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com