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The process satisfies the sustainability principles of waste minimization, use of benign reagents and process intensification at mild conditions.
Design-adaptive allocation methods (minimization) use only patients' baseline characteristics to determine the allocation of the next patient [ 34].
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Energy was minimized (Impref minimization) using RMSD 0.30 Å and converged by OPLS2005 force field utilities of Schrödinger's suite 9.3.
We carried out the minimization using the local minimizer 'lsqnonlin' function of Matlab [ 27, 28].
All the resulting structures were energy minimized with a standard 100 ABNR steps minimization using the software CHARMm [26], and charmm19 parameters.
Energy minimization using quantum-chemical calculations provides one option, which can be especially useful for the determination of accurate positions for H atoms (Deringer et al., 2012 ▶).
Model geometry was minimized and the model subjected to 500 steps of geometry idealization and energy minimization using Phenix (Adams et al., 2010).
The objective of this experiment was to look for cost minimization using different natural adsorbents.
Elad [29] designed the measurement matrix based on mutual coherence minimization using a shrinkage operation.
The models were optimized by potential energy minimization using the SYBYL ® software package.
RPATh calculation was finally performed with 3000 steps of ABNR minimization, using 16 replicas.
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