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Modified Genetic Algorithm to Model Crystal Structures: III. Determination of Crystal Structures Allowing Simultaneous Molecular Geometry Relaxation
(John Wiley & Sons Inc, 2004-12)
The modified genetic algorithm (MGAC) has been extended to allow simultaneous relaxation of molecular geometry during optimization of the crystalline structure. The method was applied to L-alanine and DL-alanine for two ...
Experimental and ab initio study of the structural and optical properties of ZnO coatings: Performance of the DFT+U approach
(University of Novi Sad, 2020-12)
In this work, ZnO coatings were produced by the spray-pyrolysis technique and characterized by scanning electron microscopy, X-ray diffraction and optical transmittance spectroscopy. The experimental results were compared ...
Le Corbusier and a New Structural System as the Germ of the Modern Grammar
(David Publisher, 2017)
The opposition between the terms carcasse (carcass), conceptualized by Auguste Perret, and ossature (frame), proposed as an alternative by Le Corbusier, gives rise to the exploration of the capital contribution of the ...
Predicting 13Ca chemical shifts for validation of protein structures
(Springer, 2007-07)
The 13Ca chemical shifts for 16,299 residues from 213 conformations of four proteins (experimentally determined by X-ray crystallography and Nuclear Magnetic Resonance methods) were computed by using a combination of ...
Reliability analysis applied to structural ceramic blocks
(ANTAC - Associação Nacional de Tecnologia do Ambiente Construído, 2018)
Overview of anticoagulant activity of sulfated polysaccharides from seaweeds in relation to their structures, focusing on those of green seaweeds
(Bentham Science Publishers, 2010-05)
The anticoagulant behavior of sulfated polysaccharides from seaweeds is reviewed based on their chemical structures. Analysis of the literature suggested that the driving force for the formation of the sulfated polysaccharide/ ...
Lattices in almost abelian Lie groups with locally conformal Kähler or symplectic structures
(Springer, 2018-03)
We study the existence of lattices in almost abelian Lie groups that admit left invariant locally conformal Kähler or locally conformal symplectic structures in order to obtain compact solvmanifolds equipped with these ...
Influence of various parameters in the seismic soil-structure interaction response of a nuclear power plant
(Elsevier, 2020-08-15)
This paper presents a numerical study of the influence of various parameters on the seismic response of the CAREM-25 nuclear power plant (NPP) located in Argentina. The influence of soil stiffness, structure-soilstructure ...
Evidencias de estructura poblacional y estructura genética espacial a escala fina en poblaciones argentinas de Acacia furcatispina (Fabaceae)Evidences of population structure and spatial genetic structure at fine scale in Argentinean populations of Acacia furcatispina (Fabaceae)
(Sociedad Argentina de Botánica, 2019-03)
Background and aims: Acacia furcatispina belongs to the subgenus Aculeiferum. Currently, there are no studies in population genetics in this species. The aim of this work was to investigate the genetic diversity, population ...