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3rd International Conference cum Workshop on
"Recent Trends in Structural Bioinformatics and Computer Aided Drug Design"
[ICSBCADD'2025]
17th-19th December, 2025
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Abstract Status

S.No Name Institution Designation Title of the Abstract Type of Presentation Status
1 Aditi Roy Vellore Institute of Technology, Vellore Research Scholar Identification of Berberine Analogues as Promising Escherichia coli FtsZ Inhibitors Through Machine Learning, Molecular Docking, and Molecular Dynamics Approaches Oral Accepted
2 Avani Panickar Vellore Institute of Technology, Vellore Research Scholar Machine learning and DFT-based discovery of natural inhibitors against β-lactam-resistant PBP2x mutants in Streptococcus pneumoniae Oral Accepted
3 Elizabeth Annie George Vellore Institute of Technology, Vellore Research Scholar Novel HFIAP-1 Mutant Antimicrobial Peptide Identified as a Potential Inhibitor of Extended-Spectrum β-Lactamases in Escherichia coli: An In-silico Study Oral Accepted
4 Dr. A. Bharathi Sir Theagaraya College, Chennai Associate Professor Docking and Molecular Dynamics Simulations of Anti-Hypertensive Peptides from Seaweeds Oral Accepted
5 Srujal Kacha Vellore Institute of Technology (VIT), Vellore Research Scholar Computational Identification of Novel Therapeutics for the PBP3 F533L Mutant of Pseudomonas aeruginosa Using Machine Learning Techniques Oral Accepted
6 Rhitam Biswas Vellore Institute of Technology (VIT), Vellore Research Scholar Structure-Based Identification of Novel Zinc-Binding Inhibitors Against the Essential Metalloprotein DapE in Klebsiella pneumoniae Oral Accepted
7 Sara Pearl Vellore Institute of Technology (VIT), Vellore Research Scholar Unraveling the Genomic Complexity of Resistome, Virulome, and Mobilome in Nosocomial Acinetobacter baumannii Oral Accepted
8 Romita Guchhait Vellore Institute of Technology (VIT), Vellore Research Scholar Machine learning and Cheminformatics Approach for Screening Lichen-Derived Inhibitors Targeting Mutant PBP4R200L in Staphylococcus aureus Poster Accepted
9 Santhiya Vijayakumar Vellore Institute of Technology (VIT), Vellore Research Scholar Genome-guided exploration of marine Streptomyces sp. and Nocardiopsis sp. for their biosynthetic and drug-development potential Poster Accepted
10 Chandni Krishnan Vellore Institute of Technology (VIT), Vellore Research Scholar In Silico Evaluation of natural bioactive compounds targeting against RgpB of Porphyromonas gingivalis Poster Accepted
11 Bhuvaneswari Narthanareeswaran DBI, Alagappa University Research Scholar Reverse vaccinology–based prioritization of hypothetical proteins for multi-epitope vaccine development against MDR Pseudomonas aeruginosa JJPA01 Poster Accepted
12 Maheswari Narthanareeswaran DBI, Alagappa University Research Scholar Integrative Subtractive Genomics and Structure-Based Screening Reveal CheR as a Promising Therapeutic Target in Leptospira interrogans Poster Accepted
13 Soumyadip Ghosh Vellore Institute of Technology (VIT), Vellore Research Scholar An Integrative Structure-Based In Silico and Quantum Simulation Approaches Uncover a Promising Quinoline Scaffold as GyrA Inhibitor against Fluoroquinolone Resistant in Pseudomonas aeruginosa Poster Accepted
14 Bhuvana Kumar SASTRA Deemed to be University, Thanjavur Research Scholar Vanillin attenuates AGEs, Glycation-Induced Oxidation & Aggregation of Serum Transferrin: Insights from biophysical and in silico studies Poster Accepted
15 Darthi Anthony Raj SASTRA Deemed to be University, Thanjavur Research Scholar Dual Role of Trigonelline in Targeting the Core Residues of HEWL: Inhibition of Fibrillation and Enhancement of Enzyme Activity Poster Accepted
16 Ambiga Chinnathambi DBT, Alagappa University Research Scholar In-silico study of 1-methyl-3-phenylindole from Terminalia bellirica as an estrogen receptor modulator for breast cancer treatment Oral Accepted
17 Jeyanthi Sankar DBI, Alagappa University Research Scholar Structure-Based Repurposing of FDA-Approved Antiviral Drugs targeting hMPV F Protein: Insights from Molecular Docking and Dynamics Analysis Poster Accepted
18 Muralidharan Jothimani DBI, Alagappa University Research Scholar Pharmaco-Informatics Profiling of Small Molecules Targeting c-Kit Protein Oral Accepted
19 Sakthi Sasikala Sundaravel DBI, Alagappa University Research Scholar Computational Identification of Deleterious SNPs in Migraine and Anxiety Regulatory Genes: A Pharmacogenomic Perspective Poster Accepted
20 Sushma Shruthi Jagannathan DBI, Alagappa University Research Scholar Natural Reactivation of p53: Discovery of Potent MDM2 Inhibitors from Ziziphus nummularia for Ovarian Cancer Therapy Poster Accepted
21 Swetha Subramaniyan DBI, Alagappa University Research Scholar Nutrigenomics and Computational Screening of Traditional Plant Phyto compounds against Tankyrase in Hepatocellular carcinoma Poster Accepted
22 Gopalakrishnan Shankari Karpagam Academy of Higher Education, Coimbatore Research Scholar Small molecules targeting ARID1A in the MDA-MB-231 cell line revealed by hub gene analysis of SWI/SNF chromatin remodeling complex in along with structure-based virtual screening and in vitro confirmation. Oral Accepted
23 Gowri Sundaraganesan DBI, Alagappa University Research Scholar Computational Evaluation of GC–MS Derived Phytocompounds from Two Medicinal Plants as Potential RAC1 Inhibitors for Breast Cancer Therapy Oral Accepted
24 Rajesh Sivamoorthy DBI, Alagappa University Research Scholar Computational Exploration of Amomum subulatum Phytocompounds Through Network Pharmacology to Identify Hub Genes and Potential Therapeutics for Breast Cancer Oral Accepted
25 R. Narmatha DBI, Alagappa University Research Scholar Computational and Experimental Investigation of phytocompounds from Andrographis echioides plant and synthesis of Metal Oxide nanoparticles by green method Oral Accepted
26 Saravanan Priyadharshini DBI, Alagappa University Research Scholar Systematic Analysis to Identify Prognostic Biomarkers, Potential Target, and Natural Inhibitors for Cervical Cancer Oral Accepted
27 Muthuraja Arun Pravin DBI, Alagappa University Research Scholar Integrative ML-Guided Multi-Omics and Structure-Based Drug Design to Unveil Diagnostic Biomarkers and Host-Directed Therapeutics Against Dengue Virus Oral Accepted
28 Muthulakshmi Muthumanickam DBT, Alagappa University Research Scholar Targeting Bcl-2 anti-apoptotic receptor with gossypetin from Moringa oleifera: An in silico study for colorectal cancer prevention Oral Accepted
29 Rajaram Abhirami DBI, Alagappa University Research Scholar Disrupting TasA-Induced NF-κB Activation in Bacillus cereus Biofilms: A Novel Strategy for Gastric Cancer Prevention Oral Accepted
30 Sreedevi Radhakrishnan Vellore Institute of Technology (VIT), Vellore Research Scholar Comparative Transcriptomic Analysis of Alzheimer’s Disease Across Diverse Populations for Target and Pathway discovery Poster Accepted
31 Dr. Manikandan Jayaraman DBI, Alagappa University Project Scientist- I Computational Insights into Potential Marine Natural Products as Selective Inhibitors of Mycobacterium tuberculosis InhA: A Structure-Based Virtual Screening Study Oral Accepted
32 Pradeep Kumar Sriram DBI, Alagappa University Research Scholar Investigating Marine Natural Products as Prospective Anti-AgrA Drug Candidates Against Enterococcus faecium: A Subtractive Proteomics Facilitated Multi-Tier Screening Study for Addressing Antimicrobial Resistance Oral Accepted
33 Maharaja Muthuvairam Subbulakshmi DBI, Alagappa University Research Scholar A Multi-Tiered Computational Framework for Functional and Structural Characterization of Hypothetical Proteins in Nocardia asteroides FDAARGOS1485: An Integrated Structure-Based Virtual Screening and Molecular Dynamics Validation of Marine-Derived Inhibitors Oral Accepted
34 Heyram Krishnakumar DBI, Alagappa University Research Scholar Multi-Targeted Computational Evaluation of Phytochemical Modulators Targeting Metabolic Enzymes SIK2 and GCK in Type 2 Diabetes Oral Accepted
35 M. Manikandan DBI, Alagappa University Research Scholar Computational Design of a Novel Disulfide-Bond Based Prodrug IMQ-S-S-IMQ for Breast Cancer Therapy Oral Accepted
36 R.Yadav Indian Institute of Information Technology (IIIT), Jabalpur Research Scholar AI-Driven Drug Design and Screening of Aryl Benzoyl Hydrazide Analogues as Potential Inhibitors of ZIKV NS2B-NS3 Protease Oral Accepted
37 Selvaraj Anupriya Madurai Kamaraj University, Madurai Research Scholar Integrated Computational Identification and Evaluation of Novel c-Src Inhibitors as Potential Therapeutics for Colorectal Cancer Oral Accepted
38 R. Daheriya Indian Institute of Information Technology (IIIT), Jabalpur Research Scholar Structure and Stability of Different Tautomers of Some Antibiotics Oral Accepted
39 Vidya Jyothi Alli CSIR-Indian Institute of Chemical Technology, Hydrabad Research Scholar Ligand Based Pharmacophoric Discovery of New CLK1 Inhibitors Poster Accepted
40 Darun Rithik Mathiyalagan Bharathiar University, Coimbatore M.Sc. Student InSilico Drug Repurposing Integrated with Structural Insights to Identify Potent GtfB Targeted Antibiofilm Inhibitors in Streptococcus mutans Poster Accepted
41 Esackimuthu P SASTRA Deemed to be University, Thanjavur Research Scholar Structural and Functional Insights into Hemoglobin Glycation Poster Accepted
42 Kavitha J Pasumpon Thiru Muthuramalinga Thevar Memorial College (Affliated to Alagappa University),Kamuthi, Ramnad District Research Scholar Relative stress Protein Profile of Wild edible legumes Using Sodium Dodecyl Sulfate Polyacrylamide Gel Electrophoresis (SDS-PAGE) under salinity stress Poster Accepted
43 Lavanya Devi G Central University of Tamil Nadu, Thiruvarur Research Scholar QSAR modelling, molecular docking, and ADMET studies of imidazole pyridine derivatives toward anticancer drug development Poster Accepted
44 Mohanraj Mani Vellore Institute of Technology, Vellore Research Scholar Identification of blood-derived key hub gene biomarkers associated with chronic obstructive pulmonary disease using a comprehensive bioinformatics and machine learning approach Poster Accepted
45 Soundar Rajan Kulandhaivel DBI, Alagappa University Research Scholar Uncovering Natural CARM1 Inhibitors for Breast Cancer from Hibiscus Species - A Multistep Computational Approach Integrating Docking, Pharmacophore Modeling and MD Simulations Poster Accepted
46 Rubhashri Gurunathan DBI, Alagappa University Research Scholar Molecular Modeling and Dynamics-Based Structural Characterization of the HTLV-1 SU Protein (gp46) Oral Accepted
47 Gopika Dhanya DBI, Alagappa University Project Assistant Monitoring of Vibrio and Salmonella in Shrimp Aquaculture Water Using Modified Moore Swab Method Poster Accepted
48 Saveetha Karuppasamy DBI, Alagappa University Project Assistant Molecular Characterization of Vibrio Species in Coastal Shrimp Farms Poster Accepted
49 Sappanimuthu Priyanka DBI, Alagappa University Research Scholar Structural and Mechanistic Analysis of WaaQ in Coordinating LPS Core Assembly in Multidrug-Resistant Klebsiella pneumonia through Computational Approaches Oral Accepted
50 Balasubramanian Sivaprakasam DBI, Alagappa University Research Scholar Computational Evaluation of Hemidesmus indicus Phytochemicals as Potent HSP90 Inhibitors in Ovarian Cancer Treatment Poster Accepted
51 Shaslinah Nathar DBI, Alagappa University Research Scholar Computational Characterization of Novel Alpha/Beta Hydrolase Fold Domain Containing Protein involeved in Pathogenecity and Antibiotic Resistance in Nocardia farcinica Poster Accepted
52 Raji Rajmichael DBI, Alagappa University Research Scholar Genomic and Environmental Profiling of Vibrio Isolates from Shrimp Aquaculture Systems Poster Accepted
53 Dr. Thiyonila Berchmans DBI, Alagappa University Women Scientist Integrative 16S Metagenomic Profiling and Structure–Dynamics–Based Inhibitor Discovery Targeting ClbP in Breast Tumour Microbiomes Poster Accepted
54 Dr. J. Chitra DBI, Dr. Umayal Ramanathan College for Women, Karaikudi Associate Professor and Head Identification of Cefoxitin resistant Acinetobacter lwoffii Isolated from Decayed Apple Tissue Poster Accepted
55 Veena Radhakrishnan DBI, Alagappa University Research Scholar Genomic Insights into the Resistome and Virulence of Nocardia pneumoniae from a Post operative Ocular Infection Oral Accepted
56 Sethu Meenal DBI, Alagappa University Research Scholar Green Synthesis of Cerium Oxide Nanoparticles Supported by Molecular Docking Driven Identification of Bioactive Phytocompounds from Cymodocea serrulata Oral Accepted
57 Delsy Gnana Silvia Vellore Institute of Technology, Vellore Research Scholar Multi-Scale Analysis of KRAS Mutations in Acute Myeloid Leukemia: Integrating Network Biology, Population Genomics, and Structural Dynamics Poster Accepted
58 Dr. Rajalakshmi Kumar Jawaharlal Institute of Post-Graduate Medical Education and Research, Puducherry Project Scientist- I Computational Identification and Analysis of Deleterious Non-synonymous Single Nucleotide Polymorphisms (nsSNPs) in the Human POR gene: A Structural and Functional impact Poster Accepted
59 Dr. Mahalingam Jeyakumar DBI, Alagappa University Teaching Assistant In-silico evaluation of α-bisabolol β-D-fucopyranoside as BACE1, Amyloid-β, and Tau protein inhibitor in the treatment of Alzheimer’s disease Poster Accepted
60 Dr. Mamudha Muthumani DBI, Alagappa University Teaching Assistant Larvicidal Activity and Molecular Interaction studies of Momordica tuberosa Derived Bioactive Compounds Against AeOBP22 Protein Poster Accepted
61 M. Nithish Bishop Heber College (Autonomous), Tiruchirapalli M.Sc Student NLP-Driven screening and Computational Identification of Bioactive Peptides from Fermented Foods for Therapeutic Intervention in PCOS Management Oral Accepted
61 Dr. Rohit Karn DBI, Alagappa University Project Scientist- II In Silico Identification of selective CDK9 Inhibitors disrupting P-TEFb complex against Triple-Negative Breast Cancer Oral Accepted
62 Keerthana P Bishop Heber College (Autonomous), Tiruchirapalli M.Sc Student Bridging Traditional Knowledge and Modern Network Pharmacology: Exploring the Role of Karunguruvai Rice in PCOS Management Poster Accepted
63 Jordan Fredric J Bishop Heber College (Autonomous), Tiruchirapalli M.Sc Student Insight into Traf2 and Nck-interacting kinase role as a potential target in Colorectal Cancer Progression: Analysis of Expression Profiling and Epigenetic Analysis Poster Accepted
64 Zeeshan Hyderi DBT, Alagappa University Research Scholar Comparative Efficacy of 4,5,7-Trihydroxyflavanone (THF) and THF-Mediated Silver Nanoparticles against Enterococcus gallinarum: Insights from in vitro, in vivo, and in silico Analysis Poster Accepted
65 Dr. Anand Krishnan University of the Free State, South Africa Senior Lecturer Synergistic Application of Metabolic Glycan Labelling and Click Chemistry to create a Novel Exosome-Based Therapeutic Against AZT Toxicity Oral Accepted
66 Nithish Sathasivam Sri Ramakrishna College of Arts and Science (Autonomous), Coimbatore M.Sc Student Unveiling KIF15 Inhibition Through Molecular Docking and 100 ns Dynamics of a Natural Ligand Poster Accepted
67 Ganesan Gokhul Sri Ramakrishna College of Arts and Science (Autonomous), Coimbatore M.Sc Student Molecular Docking Analysis of Sitosterol from Miconia crenata Against NEK2 (PDB ID:2W5A) for Potential Prostate Cancer Therapy Poster Accepted
67 Vasanth shankaranaryanan Sri Ramakrishna College of Arts and Science (Autonomous), Coimbatore M.Sc Student In Silico Study of Phytochemicals from Tecomella undulata Targeting CDK2 in prostate cancer Poster Accepted
68 Nalina Viswanathan DBI, Alagappa University Research Scholar In-silico Approach of Antifungal Properties of Natural Plant Compounds Against Candida Albicans Poster Accepted
69 Samiksha V SASTRA Deemed to be University, Thanjavur B.Tech Student Pyrogallol as a Potent Natural Disruptor of Vibrio vulnificus Biofilms: An Alternative Strategy to Combat Emerging Coastal Pathogen Threats in India Poster Accepted
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