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137 articles for “energy function”
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Research ArticleOpen accessIn the abstractSimultaneous Presence of Growth and Remodeling in the Bone Adaptation TheorySeyyed Amir Hooshiar Ahmedi, Gholamreza Rouhi, Hamidreza Katouzian, Seyyed Ali Hooshiar AhmediMechanical forces acting on bone during growth affect their final shape and strength. Mechanoregulation of bone growth is maybe recognized in embryogenesis, and also in the adaptation of the adult skeleton to changes in mechanical loading. By combining equations describing bone remodeling and growth with an iterative finite element analysis, a computational model to simulate the simultaneous effects of bone … …American Journal of Applied Sciences, Vol. 6, Issue 2 · 28 Feb 2009 · 7,166 accessesView PDFCite
Research ArticleOpen accessIn the abstractNumerical Study of the Moving Boundary Problem During Melting Process in a Rectangular Cavity Heated from BelowY. Jellouli, R. Chouikh, A. Guizani, A. BelghithWe present an analysis of the melting process in Phase Change Materials (PCM) in a horizontal cavity heated from below, driven by the coupling of transient heat conduction in the solid phase and steady state laminar natural convection in the liquid phase with one of the boundaries of the solution domain that moves. We state the problem in the Cartesian … …American Journal of Applied Sciences, Vol. 4, Issue 4 · 30 Apr 2007 · 7,391 accessesView PDFCite
Research ArticleOpen accessIn the abstractPhotocurrent and Photoluminescence Investigations of GaInNAs and GaInNAs(Sb) Quantum Wells Grown by Molecular Beam EpitaxyS. Ben Bouzid, F. Bousbih, A Hamdouni et al.We have investigated photocurrent (PC) and photoluminescence (PL) in sequentially grown GaInNAs/GaAs and GaInNAs(Sb)/GaAsSbN quantum wells. Photocurrent transitions are analyzed by theoretical calculations using envelope function formalism taking into account the strain effect and the strong coupling between nitrogen localized state and the GaInAs band gap. The results are consistent with a type I band alignment and a conduction band … …American Journal of Applied Sciences, Vol. 2, Issue 9 · 30 Sep 2005 · 6,475 accessesView PDFCite
Research ArticleOpen accessIn the abstractSomething about the Mechanical Moment of InertiaFlorian Ion T. Petrescu, Antonio Apicella, Aversa Raffaella et al.In this study, the relations to determining mass moments of inertia (mechanical) for different mass and mechanical inertia corresponding to geometric shapes, objects and profiles are explored. The formulas for calculating the mass moments of inertia (mechanical) for various bodies (various geometrical forms), to certain major axis indicated (as the axis of calculation) are presented. The total mass M of … …American Journal of Applied Sciences, Vol. 13, Issue 11 · 4 Nov 2016 · 11,376 accessesView PDFCite
EditorialOpen accessIn the abstractWearable Technology: A New Era of Gadgetry InnovationHaider KhaleelToday, wearable technology comes in a wide variety of forms, from wrist and arm bands to eyewear, footwear and smart textiles. The number of wearable electronic devices available in today’s electronics market including smart watches, activity trackers, helmets and smart clothing seems to grow substantially. In fact, this technology is recognized as one of the hottest trends and one of … …American Journal of Engineering and Applied Sciences, Vol. 7, Issue 4 · 18 Apr 2015 · 7,477 accessesView PDFCite
Research ArticleOpen accessIn the abstractIn Silico and in Vitro Studies: Tryparedoxin Peroxidase Inhibitor Activity of Methotrexate for Antileishmanial ActivityRavi Kumar Gundampati, Shraddha Sahu, Avinash Kumar Srivastava et al.In order to understand the mechanism of molecular interactions at the active site of Tryparedoxin Peroxidase (Try P), homology modeling and docking studies were performed. We generated a Three-Dimensional (3D) model of target protein based on the Crystal structure of Leishmania Major Try PI (PDB ID: 3TUE) using modeler software. Docking analysis was carried out to study the effects of … …American Journal of Infectious Diseases, Vol. 9, Issue 4 · 28 Nov 2013 · 7,893 accessesView PDFCite
Research ArticleOpen accessIn the abstractMethanol-Based Transesterification Optimization of Waste Used Cooking Oil over Potassium Hydroxide CatalystCholada Komintarachat, Sathaporn ChuepengProblem statement: Waste used Cooking Oil (WCO) harmfully affected to environment and human’s health can be a feedstock for producing biodiesel. Approach: The conversion of Fatty Acid and Free Fatty Acid (FFA) of WCO with 15.0% w/w FFA content to biodiesel was studied through transesterification reactions. This work investigated the effects of alcohol and catalyst quantity, reaction time and temperature … …American Journal of Applied Sciences, Vol. 7, Issue 8 · 31 Aug 2010 · 9,739 accessesView PDFCite
Research ArticleOpen accessIn the abstractDensity Functional Theory Based Quantitative Structure Activity Relationship Study of 2,5-Bis(1-Aziridinyl)-p-Benzoquinones with Lymphoid LeukemiaBahjat A. Saeed, Rita S. EliasProblem statement: QSAR techniques increase the probability of success and reduce time and coast in drug discovery process. The study presented QSAR investigation on 32 bioactive aziridinylbenzoquinones that have activity against lymphoid leukemia. Approach: Molecular descriptors, molecular weight, total energy, hardness, chemical potential, electrophilicity index, HOMO and LUMO energies were calculated. Initial geometry optimizations were carried out with the AM1 … …American Journal of Applied Sciences, Vol. 7, Issue 7 · 31 Jul 2010 · 7,211 accessesView PDFCite
Research ArticleOpen accessIn the abstractA Survey of Protein Fold Recognition AlgorithmsMohammed Said Abual-Rub, Rosni AbdullahProblem statement: Predicting the tertiary structure of proteins from their linear sequence is really a big challenge in biology. This challenge is related to the fact that the traditional computational methods are not powerful enough to search for the correct structure in the huge conformational space. This inadequate capability of the computational methods, however, is a major obstacle in facing … …Journal of Computer Science, Vol. 4, Issue 9 · 30 Sep 2008 · 6,877 accessesView PDFCite
Research ArticleOpen accessIn the abstractDFT Based Electrophilicity Index and QSAR study of Phenols as Anti Leukaemia AgentFarhan A. Pasha, Hemant K. Srivastava, Yakoob Beg, Pashupati P. singhDensity Functional reactivity indices based QSAR study of 49 phenol derivatives is presented in this paper. Two different models to describe the anti leukaemia activity of phenols have been made. First QSAR model includes molecular properties like molecular weight (Mw), hardness (η), chemical potential (μ), total energy, and electrophilicity index (ω). Various regression models have been made and regression quality … …American Journal of Immunology, Vol. 2, Issue 1 · 31 Mar 2006 · 7,587 accessesView PDFCite