Faculty Publications
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Item Role of N-vinyl-2-pyrrolidinone on the thermoresponsive behavior of PNIPAm hydrogel and its release kinetics using dye and vitamin-B12 as model drug(2014) Maheswari, B.; JagadeeshBabu, P.E.; Agarwal, M.Temperature-sensitive hydrogels hold great promise in biological applications as they can respond to changes in physiological temperature to produce a desired effect like controlled drug delivery. In this study, a series of poly(N-isopropylacrylamide-co-N-vinyl-2-pyrrolidinone) thermosensitive hydrogels were synthesized by radical copolymerization of NIPAm with 1-vinyl-2-pyrrolidinone (NVP). By altering the initial NIPAm/NVP mole ratios, copolymers were synthesized to have their own distinctive lower critical solution temperature which was established using differential scanning calorimetry. The swelling behavior of the hydrogel was analyzed gravimetrically and it was observed that reswelling rate increases with increasing NVP mole ratio. Further characterizations of the hydrogels were performed using Fourier transform infrared spectroscopy and scanning electron microscopy. Release kinetics with respect to temperature was studied using methylene blue dye solution and vitamin B12. Kinetic modeling of the release profile revealed that the release mechanism is a non-Fickian diffusion mechanism. These results suggested that this material has potential application as intelligent drug carriers. The quantities of residual monomers in the PIV4 hydrogel were determined by HPLC method, and the results show almost complete conversion. © 2013 Taylor & Francis.Item Synthesis and characterization of microporous hollow core-shell silica nanoparticles (HCSNs) of tunable thickness for controlled release of doxorubicin(Springer Netherlands rbk@louisiana.edu, 2018) Deepika, D.; JagadeeshBabu, J.B.Hollow core-shell silica nanoparticles (HCSNs) are being considered as one of the most favorable drug carriers to accomplish targeted drug delivery. In the present study, we developed a simple two-step method, employing polystyrene (PS) nanoparticles (150 ± 20 nm) as a sacrificial template for the synthesis of microporous HCSNs of size 230 ± 30 nm. PS core and the wall structure directing agent cetyl trimethyl ammonium bromide (CTAB) were removed by calcination. Monodispersed spherical HCSNs were synthesized by optimising the parameters like water/ethanol volume ratio, PS/tetraethyl orthosilicate (TEOS) weight ratio, concentration of ammonia, and CTAB. Transmission electron microscopy (TEM) revealed the formation of hollow core-shell structure of silica with tunable thickness from 15 to 30 nm while tailoring the concentration of silica precursor. The results obtained from the cumulative release studies of doxorubicin loaded microporous HCSNs demonstrated the dependence of shell thickness on the controlled drug release behavior. HCSNs with highest shell thickness of 30 nm and lowest surface area of 600 m2/g showed delay in the doxorubicin release, proving their application as a drug carrier in targeted drug delivery systems. The novel concept of application of microporous HCSNs of pore size ~ 1.3 nm with large specific surface area in the field of drug delivery is successful. © 2018, Springer Nature B.V.Item Role of graphene quantum dots synthesized through pyrolysis in the release behavior of temperature responsive poly (N,N-diethyl acrylamide) hydrogel loaded with doxorubicin(Taylor and Francis Inc. 325 Chestnut St, Suite 800 Philadelphia PA 19106, 2018) Havanur, S.; JagadeeshBabu, P.E.We have reported the synthesis and characterization of new drug carrier using Poly (N,N-diethyl acrylamide) (PDEA) and graphene quantum dots (GQDs). PDEA is a stimuli-responsive, macroporous polymer which has the ability to respond to change in surrounding temperature and addition of GQDs will help in improving the inherent characteristics of PDEA. In this research work, PDEA hydrogels along with GQDs have been synthesized by free radical polymerization. The effect of various concentrations of GQDs on the property of PDEA hydrogel was studied. The structural analysis of synthesized hydrogels was done using Fourier transform infrared spectroscopy (FT–IR). The internal surface morphology of porous hydrogels was observed using scanning electron microscope (SEM) micrographs. From the analysis, it has been observed that the equilibrium swelling ratio (ESR) and reswelling kinetics of the hydrogel significantly increased as the GQDs content was varied. The cancer drug (an anthracycline that is used for cancer chemotherapy) Doxorubicin (DOX) release behavior was studied and found that the performance of hydrogel is dependent on hydrogel composition, time, and surrounding temperature. The cytotoxicity of GQDs incorporated PDEA hydrogels gave a significant report which supports the potential application of hydrogel as an intelligent drug carrier. © 2018, © 2018 Taylor & Francis Group, LLC.Item Synthesis and optimization of poly (N,N-diethylacrylamide) hydrogel and evaluation of its anticancer drug doxorubicin’s release behavior(Springer London, 2019) Havanur, S.; Farheenand, V.; JagadeeshBabu, P.E.A macroporous temperature-responsive poly(N,N-diethylacrylamide) (PDEA) hydrogel was synthesized and optimized through free radical polymerization. The optimized hydrogel was achieved by evaluating the swelling characteristics, physical stability and mechanical strength through altering the components namely concentration of N,N-diethylacrylamide (monomer), ammonium peroxodisulfate (initiator), N,N?-methylbisacrylamide (cross-linker) and N,N,N?,N?-tetramethylethylenediamine (accelerator). The equilibrium swelling behavior was performed gravimetrically, and the PDEA hydrogel synthesized at 36 °C exhibited a maximum swelling of 18.332 g.g ?1 . Also, the LCST of the prepared PDEA hydrogel was found to be around 29 °C. However, the results of time-controlled swelling and deswelling kinetics indicated that hydrogels are temperature sensitive. Further, characterization of the hydrogel was performed using scanning electron microscopy, differential scanning calorimetry, thermal gravimetric analysis, and Fourier transform infrared spectroscopy. The hydrogel was assessed for its cytotoxicity in MDA-MB-231 cell line by MTT assay. The release behavior of anticancer drug doxorubicin (DOX), a hydroxyl derivative of anthracycline, was studied at above and below the LCST temperature. It was found that the DOX release from the DOX-loaded hydrogels was significantly improved when the surrounding temperature of the release media was increased near to physiological temperature. The cumulative release profile of hydrogel at different temperatures was fitted to different kinetic model equations and non-Fickian diffusion release mechanism was revealed. These results suggest that PDEA has a potential application as an intelligent drug carrier. © 2018, Iran Polymer and Petrochemical Institute.Item Poly(N,N-diethyl acrylamide)/functionalized graphene quantum dots hydrogels loaded with doxorubicin as a nano-drug carrier for metastatic lung cancer in mice(Elsevier Ltd, 2019) Havanur, S.; Batish, I.; Cheruku, S.P.; Gourishetti, K.; JagadeeshBabu, J.; Kumar, N.Cancer has emanated as a daunting menace to human-kind even though medicine, science, and technology has reached its zenith. Subsequent scarcity in the revelation of new drugs, the exigency of salvaging formerly discovered toxic drugs such as doxorubicin has emerged. The invention of drug carrier has made drug delivery imminent which is ascribable to its characteristic traits of specific targeting, effective response to stimuli and biocompatibility. In this paper, the nanoscale polymeric drug carrier poly(N,N-diethyl acrylamide) nanohydrogel has been synthesized by inverse emulsion polymerization. Lower critical solution temperature of the polymeric carrier has been modified using graphene quantum. The particle size of pure nanohydrogel was in the range of 47 to 59.5 nm, and graphene quantum dots incorporated nanohydrogels was in the range of 68.1 to 87.5 nm. Doxorubicin (hydroxyl derivative of anthracycline) release behavior as a function of time and temperature was analyzed, and the Lower critical solution temperature of the synthesized nanohydrogels has been found to be in the range of 28–42 °C. Doxorubicin release characteristics have improved significantly as the surrounding temperature of the release media was increased near to physiological temperature. Further, the cumulative release profile was fitted in the different kinetic model and found to follow a Fickian diffusion release mechanism. The hydrogel was assessed for its cytotoxicity in B16F10 cells by MTT assay. In-vivo studies were done to study the lung metastasis by melanoma cancer and the results showed a rational favorable prognosis which was confirmed by evaluating hematological parameters and the non-immunogenic nature of nanohydrogel by cytokine assay. Comprehensively, the results suggested that poly(N,N-diethyl acrylamide) nanohydrogels have potential application as an intelligent drug carrier for melanoma cancer. © 2019 Elsevier B.V.Item Fluid-Structure Interaction Study and Flowrate Prediction Past a Flexible Membrane Using Immersed Boundary Method and Artificial Neural Network Techniques(American Society of Mechanical Engineers (ASME), 2020) Kanchan, M.; Maniyeri, R.Many microfluidics-based applications involve fluid-structure interaction (FSI) of flexible membranes. Thin flexible membranes are now being widely used for mixing enhancement, particle segregation, flowrate control, drug delivery, etc. The FSI simulations related to these applications are challenging to numerically implement. In this direction, techniques like immersed boundary method (IBM) have been successful. In this study, two-dimensional numerical simulation of flexible membrane fixed at two end points in a rectangular channel subjected to uniform fluid flow is carried out at low Reynolds number using a finite volume based IBM. A staggered Cartesian grid system is used and SIMPLE algorithm is used to solve the governing continuity and Navier-Stokes equations. The developed model is validated using the previous research work and numerical simulations are carried out for different parametric test cases. Different membrane mode shapes are observed due to the complex interplay between the hydrodynamics and structural elastic forces. Since the membrane undergoes deformation with respect to inlet fluid conditions, a variation in flowrate past the flexible structure is confirmed. It is found that, by changing the membrane length, bending rigidity, and its initial position in the channel, flowrate can be controlled. Also, for membranes that are placed at the channel midplane undergoing self-excited oscillations, there exists a critical dimensionless membrane length condition L ? 1.0 that governs this behavior. Finally, an artificial neural network (ANN) model is developed that successfully predicts flowrate in the channel for different membrane parameters. © 2020 American Society of Mechanical Engineers (ASME). All rights reserved.Item Sacrificial sulphonated polystyrene template-assisted synthesis of mesoporous hollow core-shell silica nanoparticles for drug-delivery application(Springer, 2020) Doddamani, D.; JagadeeshBabu, J.Spherical mesoporous hollow core-shell silica nanoparticles (HCSNs) of size 200 ± 50 nm with tunable thickness from 20 to 60 nm are synthesized using a sacrificial sulphonated polystyrene (PS, particle size 160 nm) template. A facile method is adopted for the sulphonation of PS using sulphuric acid, which enhanced the negative charge on the surface of PS as confirmed by zeta potential analysis and Fourier transform infrared radiation analysis. The thickness of the silica shell is tuned by altering the concentration of the silica precursor and is found to increase due to the use of the sulphonated PS template. N2 adsorption/desorption studies reported the variation of specific surface area of HCSNs from 644.1 to 197.8 m2 g?1 and average pore size from 1.55 to 3.4 nm. The drug release behaviour of HCSNs with different shell thicknesses is investigated using doxorubicin as the model drug. A delay in the drug release for ~300 min is successfully achieved by employing HCSNs with enhanced thickness of 60 nm. Application of HCSNs in targeted drug delivery was further supported by the in-vitro cytotoxicity studies carried out on lung adenocarcinoma cells. © 2020, Indian Academy of Sciences.Item Error analysis of Haar wavelet-based Galerkin numerical method with application to various nonlinear optimal control problems(Taylor and Francis Ltd., 2024) Madankar, S.R.; Setia, A.; M, M.; Vatsala, A.S.First, this paper defines a general nonlinear optimal control problem with state/control constraints and its approximation problem as the Haar wavelet Galerkin optimal control problem (HWGOCP). Then, a Haar wavelet-based Galerkin numerical method has been developed, which converts it to a nonlinear optimization problem. We theoretically prove that a Haar wavelet feasible solution of HWGOCP will exist. We also show that the approximate solutions of HWGOCP are consistent and converge to the optimal solution of the problem. A variety of application problems have been considered, which include optimal control of tumour growth using Chemotherapy drugs, optimal control of infection via the SIS model using treatment, the Brachistochrone problem in mechanics, optimal control of mold using a fungicide, optimal control of pH value of a chemical reaction to determine the quality of a product, etc. © 2024 Informa UK Limited, trading as Taylor & Francis Group.Item Effect of peptide hydrophilicity on membrane curvature and permeation(American Institute of Physics, 2024) Mathath, A.V.; Chakraborty, D.Using a well-developed reaction coordinate in umbrella sampling, we studied the single peptide permeation through a model cancerous cell membrane, varying the hydrophilicity and the charge of the peptides. Two peptides, melittin and pHD108, were studied. The permeation mechanism differs from a barrel-stave-like mechanism to toroidal pore and vesicle formation based on the number and the placement of the hydrophilic amino acids in the peptide. Membrane curvature changes dynamically as the permeation process occurs. In the case of vesicles, the peptide traverses along a smooth, homogenous pathway, whereas a rugged, steep pathway was found when lipid molecules did not line up along the wall of the membrane (barrel-stave-like mechanism). A mechanism similar to a toroidal pore consists of multiple minima. Higher free energy was found for the permeating terminal containing charged amino acid residues. Vesicle formation was found for pHD108 peptide N-terminal with a maximum membrane thinning effect of 54.4% with free energy cost of 8.20 ± 0.10 kcal mol?1 and pore radius of 2.33 ± 0.07 nm. Insights gained from this study can help to build synthetic peptides for drug delivery. © 2024 Author(s).Item Synthesis and characteristics of Fe/Ni/Cr oxide nanoparticles/PLA hybrid composite coatings on Mg–Zn–Ca alloy(Elsevier Editora Ltda, 2025) Kumar, P.; Kudva S, A.; T, A.; S, R.; Ramesh, M.R.; Prabhu, A.; Anne, G.Biodegradable materials research is dominated by magnesium and alloys thereof due to their excellent compatibility with biological barriers and biomechanical strength. Despite this, the rapid degradation of these materials in the physiological environment is the primary obstacle hindering their utilization in biomedical applications. This issue must be resolved before considering their use in clinical applications. To improve resistance towards corrosion and enhance biological efficacy and compatibility, the surfaces were coated with polylactic acid (PLA) using dip-coating. In this study, iron (Fe), nickel (Ni), and chromium (Cr) oxide nanoparticles from the Coleus amboinicus extract are synthesized and mixed with PLA to develop hybrid composite coatings, which are then applied onto the Mg–4Zn–1Ca alloy. Coleus amboinicus is known for its various medicinal properties, including immunoregulatory effects, antimicrobial activity, anti-inflammatory properties, and potential use in treating sepsis and other ailments. The extracted FeNiCr was used the develop composite coatings on Mg–4Zn–1Ca alloy. The coating improves biocompatibility, antibacterial properties, and overall performance of biomedical implants. These composite coatings were evaluated for their morphological and optical characteristics using a scanning electron microscope (SEM), 3-D non-contact profilometer, Fourier transform infrared spectroscopy (FTIR), and X-ray diffraction (XRD). The corrosion characteristics of developed samples were measured by electrochemical corrosion in standard simulation body fluid (SBF) at 37 °C. Furthermore, cytocompatibility of the PLA hybrid composites on osteoblast cells and apoptosis detection using acridine orange-ethidium bromide. Our developed coating showed ratings of 5B and 4B were obtained for FeNiCr/PLA NC- ball burnished (BB) Mg and FeNiCr/PLA nano composite (NC)–Mg samples, respectively, demonstrating the exceptional coating strength and the substrate. The corrosion rate of the FeNiCr/PLA NC-BB-Mg sample (0.02890 mm/y) is two-fold times increased against comparison with the H Mg sample (0.00012 mm/y). Cytocompatibility indicates their cytocompatibility for bone implant applications. © 2025 The Authors