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Two kinds of typical thermal insulation materials were selected, rigid polyurethane (RPU) and extruded polystyrene (XPS) foams.
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We carried out best practice unconstrained rigid docking using a selected set of 50 potent compounds from the published benzimidazole series (Table S1).
To simplify the problem, the tool was selected as a rigid material and workpiece was supposed to be a rigid-viscoplastic material.
Patients undergoing cMIS should be carefully selected to avoid fixed, rigid deformities and a preoperative sagittal vertical axis of greater than 10 cm; surgeons should consider alternative techniques in those patients.
Enantiopure cycloadducts between glycals and alkyl or aryl heterodienes were selected as small, rigid, nonpeptide molecules able to superimpose to the structure of the cyclopeptide tachykinin NK-2 antagonist 1.
The tool used is commercial package ANSYS 15.0, where SOLID-187 element is selected for all rigid platforms while BEAM-189 element is selected for all flexure beams which connecting the moving platform with the fixed platform.
In a first step we performed minimization of all selected conformers in rigid surrounding protein using MMFF94 force field.
The highly selected samples and rigid experimental designs of traditional randomized, controlled trials may restrict their ability to deliver all clinically relevant information [ 6].
It should be noted that the patients included in this study were not selected according to rigid criteria, and clinical trials can be extrapolated to the general population under 70 years.
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This result is in contrast to the prediction that the conventional energy minimization method might be able to generate ligand bound conformations from their 2D ligand structures in these cases, because the selected ligands are relatively rigid and they can hardly fold.
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