Sharif Digital Repository

The present work focuses on the development of an interpretable quantitative structure-activity relationship (QSAR) model for predicting the anti-HIV activities of 67 thiazolylthiourea derivatives. This set of molecules has been proposed as potent HIV-1 reverse transcriptase inhibitors (RT-INs). The molecules were encoded to a diverse set of molecular descriptors, spanning different physical and chemical properties. Monte Carlo (MC) sampling and multivariate adaptive regression spline (MARS) techniques were used to select the most important descriptors and to predict the activity of the molecules. The most important descriptor was found to be the aspherisity index. The analysis of variance... 

This paper studied the durability, microstructure, and fire behavior of lightweight mortars based on cement, metakaolin (MK), ultrafine ground granulated blast furnace slag (UGGBFS), ceramic waste powder (CWP), and clay brick waste powder (CBWP). Two sets of mixes were prepared with two types of lightweight aggregate including lightweight expanded clay aggregate (LECA) and pumice aggregate. Regarding the durability assessment, the electrical resistivity and water absorption of the mortars were measured. The UGGBFS-based alkali-activated mortar with pumice aggregate exhibited the highest electrical resistivity and lowest water absorption, while CBWP-based geopolymer mortar with LECA showed... 

The present work is comprised of two main parts. In part 1 the Co-Ni/γ-Al2O3 catalyst was prepared using a sol-gel procedure. Then the effect of calcination variables including the calcination temperature and time on the catalytic performance for production of light olefins was investigated and optimized. The obtained results have shown that the catalyst which was calcined at 550 °C for 6 h has revealed the better catalytic performance for production of light olefins. In part 2 the effect of process conditions including the reaction temperature, H2/CO feed ratio and total reaction pressure on the catalytic performance (CO conversion%, (C2-C4) selectivity% and C5+ selectivity%) was... 

Background: Comparison of the kinematic variability and dynamic stability of the trunk between healthy and low back pain patient groups can contribute to gaining valuable information about the movement patterns and neuromotor strategies involved in various movement tasks. Methods: Fourteen chronic low back pain patients with mild symptoms and twelve healthy male volunteers performed repeated trunk flexion-extension movements in the sagittal plane at three different speeds: 20 cycles/min, self-selected, and 40 cycles/min. Mean standard deviations, coefficient of variation and variance ratio as variability measures; maximum finite-time Lyapunov exponents and maximum Floquet multipliers as... 

In this work, age hardening behavior of an ultrafine-grained (UFG) Al6063-0.8 vol.% Al2O3 nanocomposite produced via reactive mechanical alloying followed by hot extrusion method by means of T6 heat treatment was studied. The temperature and time of solutionizing and aging were optimized by the Taguchi method. The optimal heat treatment condition was found to be solutionizing at 510 °C for 1.5 h and aging at 170 °C for 8 h. The signal-to-noise (S/N) ratio and analysis of variance (ANOVA) revealed that the solutionizing temperature was the most significant factor. A novel cyclic solution treatment was developed for age hardening of Al6063-Al2O3 nanocomposite. The results showed a considerable... 

In this experimental study the effect of physical and thermal properties of various FRP bars on their performance under elevated temperatures are investigated. The parameters included the bars' diameter, type of fiber, type of resin, fiber to matrix ratio, and thermal properties were studied. Moreover, ANOVA (ANalysis Of VAriance) was performed in order to investigate the contribution of each variable on the obtained results. The results showed that in addition to the temperature, the bars' diameter, type of fiber, type of resin, and thermal properties (Tg and Td) of the FRP bars have contributions to the results, while the fiber to matrix ratio was found to be an ineffective factor. It was... 

Thermosensitive Chitosan hydrogels which can be injected into defects with minimally invasive approach were prepared. Also starch micro/nano particles were synthesized via water-in-oil (W/O) miniemulsion technique. The starch particles were incorporated into the chitosan hydrogel to prepare injectable thermosensitive hydrogel composites. Tube inverting method, compression tests, swelling studies, XRD, SEM, OM, DLS, UV–vis spectroscopy were used for investigations. Results revealed that increasing crosslinker and surfactant contents and stirring rate leads to particle size reduction. Particle size was modeled using design of experiments (DOE) via the response surface method (RSM). Due to... 

Apathy is a stressor and debilitating common condition for both stroke survivors and their caregivers. However, its effects on the postural control of these patients have not yet been investigated. Improved postural stability through withdrawing attention from postural control by concurrent cognitive task (i.e. dual-task condition) has been reported previously, but the effect of apathy, as a confounding factor, remains unknown. This study aimed to examine the effects of apathy and dual-task condition on postural control of chronic stroke survivors from biomechanical and neurophysiological perspectives. Twenty non-apathetic stroke survivors, 20 apathetic stroke survivors, and 20 sex-, age-,... 

Background: Evidence is needed regarding the air pollutant components and their sources responsible for associations between particle mass concentrations and human cardiovascular outcomes. We previously found associations between circulating biomarkers of inflammation and mass concentrations of quasi-ultrafine particles ≤ 0.25 μm in aerodynamic diameter (PM0.25) in a panel cohort study of 60 elderly subjects with coronary artery disease living in the Los Angeles Basin.Objectives: We reassessed biomarker associations with PM0.25 using new particle composition data.Methods: Weekly biomarkers of inflammation were plasma interleukin-6 (IL-6) and soluble tumor necrosis factor-α receptor II... 

In this paper, the hydrodynamic and thermal behavior of a Fe3O4 ferrofluid flow was experimentally investigated inside a cupric u-shaped tube on a horizontal surface, under the effect of a variable magnetic field. The inlet flow regime was laminar and considered under the thermal boundary conditions of the tube with a uniform heat flux, which was affected by the variable magnetic field in some regions. The purpose of the study was to investigate the effect of parameters such as volume fraction of nanoparticles, Reynolds number of the flow, the radius of the curvature, and magnetic field frequency at three levels and four factors in the flow behavior in order to increase the convection heat... 

The maximal covering location problem (MCLP) is a challenging problem with numerous applications in practice. Previous publications in the area of MCLP proposed models and presented solution methodologies to solve this problem with up to 900 nodes. Due to the fact that in real-life applications, the number of nodes could be much higher, this paper presents a customized Genetic Algorithm (GA) to solve MCLP instances, with up to 2500 nodes. Results show that the proposed approach is capable of solving problems with a fair amount of exactness. In order to fine-tune the algorithm, Tukey's Least Significant Difference (LSD) tests are employed on a set of test problems  

In this research, polysulfone (PSf) ultrafiltration (UF) membranes were prepared by a phase inversion method. Surface modification of the PSf membranes was carried out via grafting of acrylic acid as a hydrophilic monomer by free radical graft polymerization initiated by redox reaction. A central composite design (CCD) of response surface methodology (RSM) was applied to design the experiments. The process variables were acrylic acid concentration (CAA), redox system contact time (T1), and acrylic acid polymerization time (T2), while the contact angle (CA), pure water flux (PWF), and flux recovery ratio (FRR) were considered as the responses. Analysis of variance (ANOVA) demonstrated that... 

Purpose: Although it has been proposed that individuals with patellofemoral pain show less lower limb intersegmental coordination variability, the evidence to support this hypothesis is rare. The purpose of this study was, therefore, to evaluate whether individuals with patellofemoral pain exhibit less intersegmental coordination variability compared with healthy individuals during walking and running. Also, it was hypothesized that increasing task demand would exacerbate group differences regarding coordination variability measures. Methods: Three-dimensional kinematics were collected while 17 females with patellofemoral pain and 17 healthy females walked at preferred speed, and ran at... 

The permeability of roller-compacted concrete (RCC) substantially affects its functionality and safety. This study investigates the effect of mix design parameters on the performance of RCC. For this purpose, approximately 500 laboratory specimens were prepared and tested. A formula and an artificial neural network (ANN) were proposed to predict the permeability coefficient of RCC by considering the main parameters, which were then verified independently using new specimens. Furthermore, the experimental data were analyzed by the Taguchi method and analysis of variance (ANOVA) to evaluate the level of parameter contribution. Based on the results, the permeability coefficient was highly... 

This study investigates the mechanical properties of lightweight polymer concrete (LWPC) containing four different polymer ratios (10%, 12%, 14%, and 16%) tested at three different temperatures (−15 °C, +5 °C, and +25 °C) using destructive and non-destructive tests. In addition, a series of expressions are suggested to predict the splitting-tensile, flexural and impact strength of LWPC based on the main parameters and compressive strength. The analysis of variance (ANOVA) method was also used to determine relative contributions of the experimental parameters. The results of the destructive tests show that increasing the polymer ratio caused an increase in the compressive, splitting-tensile,... 

This paper investigates the influence of intumescent paint on the performance of FRP bars subjected to low (25–450 °C) and severe (450–800 °C) elevated temperatures. In this research, glass and carbon FRP bars with epoxy resin and coated with nitrogen-based intumescent paint were used. In addition to the temperature effects, a variety of FRP bar diameters were employed to determine its effect on the tensile behavior of FRP bars in the presence of intumescent paint. Further, Bayesian regression methods and ANOVA (ANalysis Of VAriance) were applied on the results to develop a predictive model form and quantify the contribution of the variables in the tensile performance of FRP bars,... 

Background: Colorectal cancer (CRC) is one of the most common malignancies in the world and has a high mortality rate. It is believed that dysfunction in the expression of mucins and aberrant expression of some lncRNAs are associated with the occurrence and development of CRC. Therefore, the aim of the present study was to investigate the expression of MUC15, MUC16, MUC20, PCAT1, CCAT1 and HOTAIR genes in colorectal cancer and its relationship with clinicopathological variables. Materials and methods: This research was prospective case-control study. Tumors from CRC patients were collected from the Taleghani Hospital, Shahid Beheshti University of Medical Sciences, Tehran, Iran. RNA... 

In the present study, three influential parameters including concentration, temperature and specific surface area of graphene nanosheets were investigated, which are the effective parameters on the viscosity and thermal conductivity of aqueous graphene nanosheets (GNP) nanofluids. A mathematical model developed by respond surface methodology (RSM) based on a central composite design (CCD). Also, the significance of the models was tested using the analysis of variance (ANOVA). The optimum results of aqueous GNP nanofluid showed that the concentration has a direct effect on the relative viscosity and thermal conductivity. Furthermore, predicted responses proposed by the Design Expert software... 

Over the last few decades, polymer concrete (PC) has been finding use in quick repairing of concrete structures. However, there have been only few studies on the mechanical behavior of PC. The aim of this study is to evaluate the mechanical behavior of PC using destructive and non-destructive tests (NDT). The mixtures were prepared with three different polymer ratios (10%, 12%, and 14%) and two different coarse aggregate sizes (4.75–9.5 mm and 9.5–19 mm). The samples were subsequently tested under three different temperatures (−15 °C, +25 °C, and +65 °C). The Taguchi method and analysis of variance (ANOVA) were used to optimize PC mixes based on the compressive, splitting-tensile, and... 

Utilization of nanoparticles in oil and gas industry has attracted considerable attention of engineers and researchers. In this article, the feasibility of nanoemulsion flooding is investigated as a method for Enhanced Oil Recovery (EOR) through coreflooding experiments, using a packed bed and real reservoir fluids. Nine different mixtures of the solvent, surfactant, and nanoparticles in the form of a nanoemulsion phase are generated and used to recover the oil in the context of an EOR process. Various tests are conducted to determine the properties of porous medium and fluids. To study the production performance of this EOR technique, pressure drop across the packed bed are measured, along...