Raghunathan Rengaswamy’s research while affiliated with Indian Institute of Technology Madras and other places

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Publications (287)


Calibration curve for the hot wire anemometer
A fourth order least square fit of the experimental data (shown as maroon dotted line) becomes the calibration curve for the hot wire anemometer in use. The polynomial equation of the fourth order fit is shown inside the plot.
Experimental setup and recorded time series
(A) Depiction of the experimental setup for data collection. It consists of a disposable mouth-piece, a mouth-piece mount housing a hot wire anemometer and a data acquisition system. (B) A typical human exhalation velocity signal measured using a standard hot wire anemometer. The time signals were sampled at 10kHz for 1.5 seconds.
Multifractal spectra for different segments of a time signal
The multifractal spectra corresponding to the entire time signal (maroon) and time segments X, Y and Z (black, bounded by gray band) in (A) are shown in (B). It is evident that few segments exhibit an inverted parabola shape and spectrum B has a distortion.
The multifractal spectrum
Plot of the spectrum of singularities f(α) against the singularity strength α, computed for an exhalation time series segment. The parameters β, ω and ϵ are the features that characterize a multifractal spectrum.
Flow chart of the algorithm
Flow chart showing the algorithm pipeline, including time series normalization, filtering, feature extraction, feature reduction, and data splitting into training and testing. The time signal shown here is one of the segments of the original time series. Note that the representation of blue bar for training dataset and green bar for testing dataset will be consistent in further discussions in this manuscript. The training data of all users were used for building ⁿC2 binary classifier models, which becomes the process known as enrollment.

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User authentication system based on human exhaled breath physics
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April 2024

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24 Reads

Mukesh Karunanethy

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Rahul Tripathi

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Raghunathan Rengaswamy

This work, in a pioneering approach, attempts to build a biometric system that works purely based on the fluid mechanics governing exhaled breath. We test the hypothesis that the structure of turbulence in exhaled human breath can be exploited to build biometric algorithms. This work relies on the idea that the extrathoracic airway is unique for every individual, making the exhaled breath a biomarker. Methods including classical multi-dimensional hypothesis testing approach and machine learning models are employed in building user authentication algorithms, namely user confirmation and user identification. A user confirmation algorithm tries to verify whether a user is the person they claim to be. A user identification algorithm tries to identify a user’s identity with no prior information available. A dataset of exhaled breath time series samples from 94 human subjects was used to evaluate the performance of these algorithms. The user confirmation algorithms performed exceedingly well for the given dataset with over 97% true confirmation rate. The machine learning based algorithm achieved a good true confirmation rate, reiterating our understanding of why machine learning based algorithms typically outperform classical hypothesis test based algorithms. The user identification algorithm performs reasonably well with the provided dataset with over 50% of the users identified as being within two possible suspects. We show surprisingly unique turbulent signatures in the exhaled breath that have not been discovered before. In addition to discussions on a novel biometric system, we make arguments to utilise this idea as a tool to gain insights into the morphometric variation of extrathoracic airway across individuals. Such tools are expected to have future potential in the area of personalised medicines.

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Development and external validation of Indian population-specific Garbhini-GA2 model for estimating gestational age in second and third trimesters

March 2024

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99 Reads

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Background A large proportion of pregnant women in lower and middle-income countries (LMIC) seek their first antenatal care after 14 weeks of gestation. While the last menstrual period (LMP) is still the most prevalent method of determining gestational age (GA), ultrasound-based foetal biometry is considered more accurate in the second and third trimesters. In LMIC settings, the Hadlock formula, originally developed using data from a small Caucasian population, is widely used for estimating GA and foetal weight worldwide as the pre-programmed formula in ultrasound machines. This approach can lead to inaccuracies when estimating GA in a diverse population. Therefore, this study aimed to develop a population-specific model for estimating GA in the late trimesters that was as accurate as the GA estimation in the first trimester, using data from GARBH-Ini, a pregnancy cohort in a North Indian district hospital, and subsequently validate the model in an independent cohort in South India.



Fig. 1: Outline of the data selection process for TRAINING and TEST set. Exclusion criteria for each step are indicated. N p indicates the number of participants included or excluded by that criterion, and N o shows the number of unique observations derived from the participants in a dataset.
Fig. 3: Performance of Garbhini-GA2 model in terms of PTB rate in TEST set derived from the GARBH-Ini cohort. (A) PTB rates by various models: PTB rates are labelled by each model with 95% confidence intervals on the TEST set (N o = 1430). (B-D) Comparison of individual-level classification of preterm birth by a model and gold standard GA. Green (term birth for both), red (preterm birth for both), blue (term birth for gold standard but preterm birth for model) and purple (term for model but preterm for gold standard).
Development and external validation of Indian population-specific Garbhini-GA2 model for estimating gestational age in second and third trimesters

February 2024

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209 Reads

The Lancet Regional Health - Southeast Asia

Background A large proportion of pregnant women in lower and middle-income countries (LMIC) seek their first antenatal care after 14 weeks of gestation. While the last menstrual period (LMP) is still the most prevalent method of determining gestational age (GA), ultrasound-based foetal biometry is considered more accurate in the second and third trimesters. In LMIC settings, the Hadlock formula, originally developed using data from a small Caucasian population, is widely used for estimating GA and foetal weight worldwide as the pre-programmed formula in ultrasound machines. This approach can lead to inaccuracies when estimating GA in a diverse population. Therefore, this study aimed to develop a population-specific model for estimating GA in the late trimesters that was as accurate as the GA estimation in the first trimester, using data from GARBH-Ini, a pregnancy cohort in a North Indian district hospital, and subsequently validate the model in an independent cohort in South India. Methods Data obtained by longitudinal ultrasonography across all trimesters of pregnancy was used to develop and validate GA models for the second and third trimesters. The gold standard for GA estimation in the first trimester was determined using ultrasonography. The Garbhini-GA2, a polynomial regression model, was developed using the genetic algorithm-based method, showcasing the best performance among the models considered. This model incorporated three of the five routinely measured ultrasonographic parameters during the second and third trimesters. To assess its performance, the Garbhini-GA2 model was compared against the Hadlock and INTERGROWTH-21st models using both the TEST set (N = 1493) from the GARBH-Ini cohort and an independent VALIDATION dataset (N = 948) from the Christian Medical College (CMC), Vellore cohort. Evaluation metrics, including root-mean-squared error, bias, and preterm birth (PTB) rates, were utilised to comprehensively assess the model's accuracy and reliability. Findings With first trimester GA dating as the baseline, Garbhini-GA2 reduced the GA estimation median error by more than three times compared to the Hadlock formula. Further, the PTB rate estimated using Garbhini-GA2 was more accurate when compared to the INTERGROWTH-21st and Hadlock formulae, which overestimated the rate by 22.47% and 58.91%, respectively. Interpretation The Garbhini-GA2 is the first late-trimester GA estimation model to be developed and validated using Indian population data. Its higher accuracy in GA estimation, comparable to GA estimation in the first trimester and PTB classification, underscores the significance of deploying population-specific GA formulae to enhance antenatal care. Funding The GARBH-Ini cohort study was funded by the Department of Biotechnology, Government of India (BT/PR9983/MED/97/194/2013). The ultrasound repository was partly supported by the Grand Challenges India-All Children Thriving Program, 10.13039/501100014825Biotechnology Industry Research Assistance Council, Department of Biotechnology, Government of India (BIRAC/GCI/0115/03/14-ACT). The research reported in this publication was made possible by a grant (BT/kiData0394/06/18) from the Grand Challenges India at 10.13039/501100014825Biotechnology Industry Research Assistance Council (BIRAC), an operating division jointly supported by DBT-BMGF-BIRAC. The external validation study at 10.13039/501100005918CMC Vellore was partly supported by a grant (BT/kiData0394/06/18) from the Grand Challenges India at 10.13039/501100014825Biotechnology Industry Research Assistance Council (BIRAC), an operating division jointly supported by DBT-BMGF-BIRAC and by Exploratory Research Grant (SB/20-21/0602/BT/RBCX/008481) from Robert Bosch Centre for Data Science and Artificial Intelligence (RBCDSAI), 10.13039/501100003845IIT Madras. An alum endowment from Prakash Arunachalam (BIO/18-19/304/ALUM/KARH) partly funded this study at the Centre for Integrative Biology and Systems Medicine, 10.13039/501100003845IIT Madras.



Design of spinning disk atomization equipment for synthesis of drug-loaded microparticles

October 2023

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29 Reads

The synthesis of drug-loaded microparticles with precise control over size distribution and shape is crucial for achieving desired drug distribution in microparticles and tuning drug release profiles. Common large-scale production techniques produce microparticles with a broad particle size distribution and require challenging operating conditions. Recent methods employing microfluidics have enabled the production of microparticles with a uniform size distribution. Still, these methods are limited to low and moderate production rates and can handle fluids with a limited range of physicochemical properties. In this study, we couple the spinning disk atomization (SDA) technique for microdroplet production with a precipitation method to generate drug-loaded polymeric microparticles with a narrow size distribution. The design criteria and fabrication of equipment with a non-contact seal system that integrates spinning disk atomization and precipitation methods for conducting laboratory experiments involving volatile hydrocarbons while ensuring operational and personnel safety are discussed. The production of itraconazole drug-loaded microparticles using the SDA setup that considers the system's operation, maintenance, and safety aspects are discussed, and the system's efficiency is evaluated through material balance. This laboratory equipment is capable of producing drug-loaded microparticles with a narrow size distribution under moderate operating conditions and can be scaled up suitably to meet high production requirements. The applications of this equipment can be explored in various fields, such as the production of drug particles, conversion of waste polymers into microparticles, and microencapsulation of food ingredients.


Natural language processing methodology to obtain word embeddings.
Synthetic embedding scoring algorithm. In this figure dg refers to inter‐group distance and dp refers to inter‐period distance.
Synthetic embedding generation algorithm based on the scoring algorithm.
Synthetic embedding generation algorithm based on elemental property difference.
Perovskite‐based electrocatalyst discovery and design using word embeddings from retrained SciBERT language model

March 2023

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57 Reads

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3 Citations

With the ever‐increasing volume of scientific literature, there is a strong need to develop methods that allow rigorous information identification. In this contribution, a state‐of‐the‐art natural language processing (NLP) model was used to select perovskite materials for electrocatalytic applications from literature. This was accomplished by obtaining word embeddings for perovskite materials from the NLP model and subsequently designing downstream tasks to discover perovskite‐based electrocatalyst materials. However, embeddings could be obtained only for materials available in the literature. Consequently, a novel methodology was devised to generate embeddings for newly designed materials. Results from the analysis showed that the computed embeddings could be used to rank materials for their suitability for electrocatalytic applications. Further, the word embeddings were also employed as features in predicting the electrocatalytic activity of perovskite‐based electrocatalysts. The analysis demonstrated that the fidelity of regression models increased when the embeddings were used as features.


Fig. 5 Effects of AgNPs on folate secretion, and role of latter in affecting HCT116 viability. ( indicates control culture; indicates culture treated with 25 ppm AgNP). a The extracellular folic acid concentrations increased on exposure to AgNPs. This increase could be an outcome of the oxidative stress induced in the organism, which in turn impact folate related metabolic pathways. b MTT analysis of HCT116 treated with bacterial supernatants from cultures exposed to silver nanoparticles and control. Reduction in viability was observed for cells treated with 9th h supernatants (p-value = 0.0031), the time point corresponding to maximum concentration. Values are expressed as mean ± SD, n = 3.
Fig. 6 Variation of reaction absolute fluxes highlighting the affected metabolic pathways. a Colon vs. CRC and b colon-microbe vs. CRC-microbe models.
Fig. 7 Metabolite secretion profiles of the host and host-microbe models. a Colon vs. CRC and b colon-microbe vs. CRC-microbe. Exchange reactions with increased fluxes are depicted in red, with the same fluxes in white and reduced fluxes in black.
Metabolic modeling of host–microbe interactions for therapeutics in colorectal cancer

December 2022

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154 Reads

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16 Citations

npj Systems Biology and Applications

The onset of colorectal cancer (CRC) is often attributed to gut bacterial dysbiosis, and thus gut microbiota are highly relevant in devising treatment strategies. Certain gut microbes, like Enterococcus spp ., exhibit remarkable anti-neoplastic and probiotic properties, which can aid in silver nanoparticle (AgNPs) induced reactive oxygen species (ROS)-based CRC treatment. However, the effects of AgNPs on gut microbial metabolism have not been reported thus far. In this study, a detailed systems-level understanding of ROS metabolism in Enterococcus durans ( E. durans ), a representative gut microbe, was gained using constraint-based modeling, wherein, the critical association between ROS and folate metabolism was established. Experimental studies involving low AgNP concentration treatment of E. durans cultures confirmed these modeling predictions (an increased extracellular folate concentration by 52%, at the 9 th h of microbial growth, was observed). Besides, the computational studies established various metabolic pathways involving amino acids, energy metabolites, nucleotides, and SCFAs as the key players in elevating folate levels on ROS exposure. The anti-cancer potential of E. durans was also studied through MTT analysis of HCT 116 cells treated with microbial culture (AgNP treated) supernatant. A decrease in cell viability by 19% implicated the role of microbial metabolites (primarily folate) in causing cell death. The genome-scale modeling approach was then extended to extensively model CRC metabolism, as well as CRC– E. durans interactions in the context of CRC treatment, using tissue-specific metabolic models of CRC and healthy colon. These findings on further validation can facilitate the development of robust and effective cancer therapy.




Citations (60)


... The tangent regression of [10,9] belongs also to this class and confines itself to a linear approximation. Such methods are still successfully used, as can be seen in [48,49,50]. Basis function expansions, where the functions depend only on the space and time coordinates, are used by [51] in the context of hydrodynamics. ...

Reference:

Numerical Differentiation by Integrated Series Expansion (NDBISE) in the Context of Ordinary Differential Equation Estimation Problems
Discovering governing partial differential equations from noisy data
  • Citing Article
  • November 2023

Computers & Chemical Engineering

... These results differ from our findings, where we show a trend toward metal nitrides for ORR, as discussed in the next paragraph. Another NLP study by Muthukkumaran et al. 151 focused on discovering perovskite-based electrocatalysts. The authors retrained a SciBERT model with 1.74 million abstracts, using it to generate new perovskite compositions with synthetic embedding. ...

Perovskite‐based electrocatalyst discovery and design using word embeddings from retrained SciBERT language model

... Further, this approach may also reduce overfitting since only the significant principal components are used for the regression analysis which results in reduced model parameters. 82 The principal components chosen for the regression analysis are a linear combination of all the original features and not a subset. This proves that the embeddings have improved the features and the information present in them about the perovskites has helped the regression models predict electrochemical activity (a material property) more accurately. ...

Data Science for Engineers
  • Citing Book
  • November 2022

... By understanding where pollutants originate and how they behave in different urban micro-environments, city planners and environmental policymakers can implement more targeted and efficient interventions that are tailored specifically to the unique pollution dynamics of each area. Enhanced mitigation strategies might include traffic interventions (e.g., low emission zones, congestion charges), which utilize hyperlocal data to adjust traffic patterns and reduce congestion in areas with high vehicular emissions (Huang et al., 2021;Tang et al., 2020); pathway optimization to reduce exposure, where hyperlocal data helps design routes that minimize pedestrian and cyclist exposure to high-pollution areas (Fuest et al. 2024;Swaminathan et al., 2022); and the creation of buffer zones in strategic locations, designed based on local data to effectively separate residential areas from major pollution sources (Ghasemian et al., 2017). ...

Data science and IoT based mobile monitoring framework for hyper-local PM2.5 assessment in urban setting
  • Citing Article
  • September 2022

Building and Environment

... Using Onshape program, the CAD design was drawn, as shown in Figure 20 with the exploded view in Figure 21. The materials shown in Table 4 were collected from a paper by Bhosale et al. [37] and the dimensions in Table 5 were collected from several papers [35,36] were available to be compared with the future work. Hence, it was decided to apply CFD analysis on the Anode to observe hydrogen flow and apply mechanical analysis to observe the maximum stresses on the fuel cell, along with the safety of the components, both of which will be discussed in the next subsections. ...

Effect of gas pressure and clamping pressure on interfacial contact resistance of a cylindrical polymer electrolyte membrane fuel cell
  • Citing Article
  • October 2021

... All-solid-state lithium-oxygen batteries offer significant potential for advanced technologies, such as digitization and ML in terms of battery performance and management [213]. Digitization refers to various data collection and analysis methods used for the monitoring, control, and optimization of LOB performance. ...

Lithium-air battery electrocatalyst identification using Machine Learning and SciBERT word embeddings
  • Citing Chapter
  • January 2022

Computer Aided Chemical Engineering

... The growing scale and structural complexity of these processes present significant challenges in developing nonlinear first-principles dynamic process models. Data-based optimal control offers a promising alternative for developing advanced control approaches for nonlinear processes without the need for an accurate first-principles model [9][10][11][12][13][14][15]. ...

Integration of machine learning and first principles models

... The choice of algorithms varies from simple linear regression to complex neural networks and a wide range of tree models. [38][39][40] The question of whether one algorithm is superior to another is invalid. The truth is that the ideal algorithm for a specific application scenario should be chosen based on the specific dataset to be modeled and the specific ...

Reinforcement-Learning designs droplet microfluidic networks
  • Citing Article
  • March 2022

Computers & Chemical Engineering

... Les circuits synthétiques de gènes correspondent à l'implémentation de circuits logiques dans une cellule, à l'image des circuits électroniques [5,6]. Ces systèmes sont capables de traiter les informations provenant de l'environnement, le résultat de ce traitement déclenchant une action cellulaire (modification d'un métabolisme, modification de l'énergétique cellulaire, production de nouvelle molécule, sécrétion, etc.) [5,7]. Des cellules ont ainsi été modifiées génétiquement, par exemple pour pouvoir détecter et répondre à un signal sans fil provenant d'un smartphone (une lumière émise dans le rouge lointain [far-red light]) ou à des courants électriques transmis à l'aide d'aiguilles d'acupuncture aux cultures de cellules [8,9]. ...

Designing Biological Circuits: From Principles to Applications
  • Citing Article
  • March 2022

ACS Synthetic Biology