IJCRT Peer-Reviewed (Refereed) Journal as Per New UGC Rules.
ISSN Approved Journal No: 2320-2882 | Impact factor: 7.97 | ESTD Year: 2013
Scholarly open access journals, Peer-reviewed, and Refereed Journals, Impact factor 7.97 (Calculate by google scholar and Semantic Scholar | AI-Powered Research Tool) , Multidisciplinary, Monthly, Indexing in all major database & Metadata, Citation Generator, Digital Object Identifier(CrossRef DOI)
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Paper Title: Ai- Enhanced Firewall
Author Name(s): Ashwin kumar N.S, Adarsh.K, Muhammed Amees G.K, Muhammed Alfaz C.K, Mrs.Kalpana .M
Published Paper ID: - IJCRT2509357
Register Paper ID - 293840
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509357 and DOI :
Author Country : Indian Author, India, 560035 , Bangalore, 560035 , | Research Area: Science and Technology Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509357 Published Paper PDF: download.php?file=IJCRT2509357 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509357.pdf
Title: AI- ENHANCED FIREWALL
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Science and Technology
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d110-d122
Year: September 2025
Downloads: 115
E-ISSN Number: 2320-2882
This paper presents the AI Enhanced Firewall (AIEF), an advanced cybersecurity solution that integrates Artificial Intelligence (AI), Machine Learning (ML), and Deep Learning (DL) to strengthen traditional firewall mechanisms. Unlike conventional firewalls that rely primarily on static rule sets and signature-based filtering, the AIEF employs adaptive intelligence to detect, analyze, and mitigate sophisticated cyber threats in real time. With the rapid growth of malware, ransomware, and zero-day exploits, legacy firewalls often fail to provide sufficient protection against dynamic and evolving attack vectors. The proposed AIEF system leverages supervised and unsupervised learning models to automatically learn from network traffic patterns, identify anomalies, and apply predictive defense strategies. Using techniques such as behavior-based intrusion detection, anomaly detection, and reinforcement learning, the system adapts to new threats without requiring constant manual updates. Furthermore, the AI Enhanced Firewall integrates contextual understanding of network behavior and predictive blocking, ensuring proactive security rather than reactive defense. Its applications span enterprise networks, cloud infrastructure, IoT ecosystems, and critical sectors such as healthcare, banking, and defense. By combining AI-driven threat intelligence, automated decision-making, and adaptive learning, the AIEF enhances data confidentiality, integrity, and availability while minimizing false positives. This work demonstrates how next-generation AI-based firewalls can transform cybersecurity by creating an intelligent, resilient, and self-improving defense system against modern digital threats.
Licence: creative commons attribution 4.0
AI Enhanced Firewall, Artificial Intelligence (AI), Machine Learning (ML), Deep Learning (DL), Cybersecurity, Intrusion Detection, Anomaly Detection, Threat Intelligence, Predictive Security, Network Protection, Data Privacy, Ethical AI, Reinforcement Learning, Cloud Security, IoT Security, Adaptive Defense, Cyber Threat Prevention, Zero-Day Attack Detection, Real-Time Monitoring.
Paper Title: DIETARY HABITS AND AWARENESS ON NUTRITION AMONG THE SCHOOL CHILDREN OF JEYPORE TOWN OF ODISHA
Author Name(s): Sruti Sanchayeeta Tripathy, Dr.Harapriya Samantray
Published Paper ID: - IJCRT2509356
Register Paper ID - 292937
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509356 and DOI :
Author Country : Indian Author, India, 764001 , Jeypore, Koraput, 764001 , | Research Area: Social Science All Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509356 Published Paper PDF: download.php?file=IJCRT2509356 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509356.pdf
Title: DIETARY HABITS AND AWARENESS ON NUTRITION AMONG THE SCHOOL CHILDREN OF JEYPORE TOWN OF ODISHA
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Social Science All
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d101-d109
Year: September 2025
Downloads: 109
E-ISSN Number: 2320-2882
Growth serves as the primary global indicator of children's well-being, and adequate food intake is crucial for proper growth. Nutrition plays a significant role during the growth phase. According to estimates from WHO and UNICEF, malnutrition impacts the physical and mental functions of 2 billion children. The aim of the present study was to examine the awareness of nutrition and food habits among school-going children in Jeypore town. The study utilized a cross-sectional descriptive survey design. Data was collected from 250 school children using purposive sampling. Clinical signs were noted during data collection to evaluate nutritional deficiency diseases. The means and t-test were applied for data analysis. The results indicated that the parents of the children were knowledgeable about the nutritive value of food. Nutritional deficiency disorders were identified based on clinical signs. It was determined that the children exhibited poor eating habits. Commonly, the children either skipped breakfast, purchased snacks or junk food, ate between meals, or consumed soft drinks daily. There were no significant differences between boys and girls regarding their mean responses to food nutritive value or the eating habits they adopted. Promoting good eating habits and providing nutritional counselling to both parents and school children will not only enhance their nutritional well-being but also help them overcome current nutritional deficiency diseases.
Licence: creative commons attribution 4.0
Awareness, nutritional status, school going children, food habits, nutritional counselling
Paper Title: Digital Discourses of Food Safety: Analysing the Maggi Controversy on Twitter in India
Author Name(s): Prem Chand Yadava
Published Paper ID: - IJCRT2509355
Register Paper ID - 293863
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509355 and DOI : https://doi.org/10.56975/ijcrt.v13i9.293863
Author Country : Indian Author, India, 110067 , New Delhi, 110067 , | Research Area: Social Science All Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509355 Published Paper PDF: download.php?file=IJCRT2509355 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509355.pdf
Title: DIGITAL DISCOURSES OF FOOD SAFETY: ANALYSING THE MAGGI CONTROVERSY ON TWITTER IN INDIA
DOI (Digital Object Identifier) : https://doi.org/10.56975/ijcrt.v13i9.293863
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Social Science All
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d91-d100
Year: September 2025
Downloads: 128
E-ISSN Number: 2320-2882
Abstract: This article examines how the Maggi controversy was debated on social media, where a substance, monosodium glutamate (MSG), was found above the permitted level in these noodles in India. Drawing on qualitative content analysis of Twitter discussions, the study explores how risk perceptions were amplified, contested, and reframed in digital spaces. Findings indicate that Social media discourse emphasised MSG as a health hazard and a symbol of corporate negligence rather than discussing scientific evidence. Twitter users simultaneously expressed fear, mobilised boycott calls, circulated humour and memes, and defended Maggi against allegations. These polarised debates show how food safety controversies in India are scientific disputes, sensationalism, and distrust in corporates and regulators. The article highlights the need for transparent, culturally sensitive, and evidence-based science communication strategies to address public concerns in food safety debates.
Licence: creative commons attribution 4.0
Twitter, MSG, Maggi, food safety, public debate
Paper Title: The Impact of Social Media Usage on the Mental Well-being and Academic Stress of College Students in Kerala.
Author Name(s): Jincy TJ
Published Paper ID: - IJCRT2509354
Register Paper ID - 293858
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509354 and DOI :
Author Country : Indian Author, India, 679334 , Nilambur, 679334 , | Research Area: Management All Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509354 Published Paper PDF: download.php?file=IJCRT2509354 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509354.pdf
Title: THE IMPACT OF SOCIAL MEDIA USAGE ON THE MENTAL WELL-BEING AND ACADEMIC STRESS OF COLLEGE STUDENTS IN KERALA.
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Management All
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d84-d90
Year: September 2025
Downloads: 101
E-ISSN Number: 2320-2882
This study examines the impact of social media usage on the mental well-being and academic stress of college students in Kerala. The research employs a quantitative approach to measure daily time spent on various platforms and assess levels of academic stress and anxiety among respondents. It specifically analyzes the correlation between social media consumption patterns and psychological well-being indicators to determine if these platforms act primarily as a coping mechanism or a stressor. The study tests the hypotheses that there is no significant correlation between social media usage time and academic stress (H??), and no significant difference in anxiety levels between high-frequency and low-frequency users (H??). The findings aim to provide valuable insights for educators and mental health professionals in supporting student wellness.
Licence: creative commons attribution 4.0
Social Media, Academic Stress, Mental Well-being, Anxiety, Self-esteem, College Students, Kerala, Coping Mechanism.
Paper Title: Partition Trauma and Layered Experiences in Sunil Gangopadhyay's Arjun
Author Name(s): Dr Yash Pal Singh
Published Paper ID: - IJCRT2509353
Register Paper ID - 293826
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509353 and DOI :
Author Country : Indian Author, India, 110003 , New Delhi, 110003 , | Research Area: Arts1 All Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509353 Published Paper PDF: download.php?file=IJCRT2509353 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509353.pdf
Title: PARTITION TRAUMA AND LAYERED EXPERIENCES IN SUNIL GANGOPADHYAY'S ARJUN
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Arts1 All
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d79-d83
Year: September 2025
Downloads: 297
E-ISSN Number: 2320-2882
The present paper aims to examine the traumatic and layered experiences of the Partition victims of East Bengal by exploring the intersection of history, memory, identity, and marginality in Sunil Gangopadhyay's Arjun. This nonlinear narrative presents a compelling tapestry of chaos, communal violence, loss, anguish, and alienation endured by the displaced. Through the life and struggles of the protagonist, Arjun, the author draws a parallel to the existential crisis and moral dilemma faced by Arjuna in the Mahabharata. It exhibits that the catastrophic event of Partition renders millions of people homeless and identity less, and how the affected fight against various forms of violence and marginalisation. The paper also explores how the experiences of Arjun show that the Partition was an act of political cynicism, and how the political elites failed to assess and control the fringe elements, who galvanised the common and illiterate masses into religious frenzy by exploiting their sensitivities. The bullying of Arjun by fellow Muslim classmates, but encouragement and appreciation of him by the Muslim teachers in school in East Bengal, lecherous male gazes and denial of assistance by Hindus during the painful migration to West Bengal, administrative apathy, bullying and deadly attacks from within community, and exploitation of the vulnerable offer new perspectives about the torments of the refugees.
Licence: creative commons attribution 4.0
Partition, Communal Violence, Refugee, Trauma, Memory, Marginality.
Paper Title: Conservative Management of Post-Appendicectomy Bowel Obstruction: A Case Study
Author Name(s): Dr.Rashmi Anil Kale, Dr.Govind Dnyanoba Gutte
Published Paper ID: - IJCRT2509352
Register Paper ID - 293450
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509352 and DOI :
Author Country : Indian Author, India, 411028 , pune, 411028 , | Research Area: Humanities All Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509352 Published Paper PDF: download.php?file=IJCRT2509352 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509352.pdf
Title: CONSERVATIVE MANAGEMENT OF POST-APPENDICECTOMY BOWEL OBSTRUCTION: A CASE STUDY
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Humanities All
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d75-d78
Year: September 2025
Downloads: 101
E-ISSN Number: 2320-2882
Postoperative small bowel obstruction (SBO) is a recognized complication of abdominal surgery, most often due to adhesions. Early recognition and appropriate management are critical to prevent morbidity. We report the case of a 53-year-old female who developed bowel obstruction 10 days after open appendicectomy. She presented with abdominal pain, distension, vomiting, and constipation. Radiological evaluation confirmed features of SBO. The patient was successfully managed conservatively with nasogastric decompression, intravenous fluids, electrolyte correction, and close monitoring. Symptoms resolved within 72 hours, and she was discharged in stable condition. This case highlights that, in the absence of strangulation or peritonitis, conservative management is a safe and effective treatment option for early postoperative SBO.
Licence: creative commons attribution 4.0
Postoperative small bowel obstruction, Adhesions, Open appendicectomy, Conservative management
Paper Title: IMMEDIATE EFFECT OF ABDOMINAL HEATING COMPRESS ON BLOOD PRESSURE AND PULSE RATE IN HYPERTENSIVE PATIENTS
Author Name(s): Dr. R.L. Asha, Dr. R. Anusha, Dr. P. Allwin Christuraj, Dr. V. Shiny Mol, Dr. D. Baby Shalini
Published Paper ID: - IJCRT2509351
Register Paper ID - 293779
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509351 and DOI :
Author Country : Indian Author, India, 629161 , Nagercoil, 629161 , | Research Area: Humanities All Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509351 Published Paper PDF: download.php?file=IJCRT2509351 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509351.pdf
Title: IMMEDIATE EFFECT OF ABDOMINAL HEATING COMPRESS ON BLOOD PRESSURE AND PULSE RATE IN HYPERTENSIVE PATIENTS
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Humanities All
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d66-d74
Year: September 2025
Downloads: 100
E-ISSN Number: 2320-2882
Background:An elevated blood pressure level is called hypertension, and it has a global impact on the burden and mortality of cardiovascular disease. The force inside the body's major arteries is known as blood pressure, and it is frequently measured in both diastolic and systolic forms. Materials and Methods:The investigation was carried out at the Sree Ramakrishna Medical College of Naturopathy and Yogic Sciences and Hospital in Kulasekharam, Tamil Nadu, India. 20 hypertensive people took part in the research. After the goal of the study was explained, verbal consent was obtained. One of the characteristics of this investigation is the blood pressure measured using a sphygmomanometer both before and after the intervention. statistical analysis and result interpretation using JASP software version 0.19.3.Results:The data analysis was conducted using JASP software version 0.19.3. It is clear that naturopathic treatments significantly lessen the symptoms associated with systolic blood pressure (t -23.637, Sig 2tailed. < 0.001) and diastolic blood pressure dropped (t -28.185, sig 2tailed. < 0.001). The pulse rate dropped (t-12.348, sig 2 tailed < 0.001). Conclusion: Given the benefits of naturopathic biotherapies, it would be prudent to add them to conventional treatment regimens to help manage the symptoms of hypertension and reduce the side effects of pharmaceutical use. The goal of naturopathy is to reduce the root cause of hypertension in order to prevent and treat it. The noteworthy outcome shows that using an abdominal heating compress helps to regulate blood pressure and lowers the amount of stress we encounter on a daily basis.
Licence: creative commons attribution 4.0
Hypertension, Abdominal heating compress, Pulse rate, Blood pressure.
Paper Title: "Synthesis of Lemongrass Silver Nanoparticles (LAgNPs) and it's role in preservation and conservation of Palm Leaves Manuscripts (PLMs)".
Author Name(s): Dr. Ashwini M, Dr. Ramakrishna Bhat K
Published Paper ID: - IJCRT2509350
Register Paper ID - 293865
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509350 and DOI :
Author Country : Indian Author, India, 560054 , Bengaluru, 560054 , | Research Area: Life Sciences All Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509350 Published Paper PDF: download.php?file=IJCRT2509350 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509350.pdf
Title: "SYNTHESIS OF LEMONGRASS SILVER NANOPARTICLES (LAGNPS) AND IT'S ROLE IN PRESERVATION AND CONSERVATION OF PALM LEAVES MANUSCRIPTS (PLMS)".
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Life Sciences All
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d63-d65
Year: September 2025
Downloads: 91
E-ISSN Number: 2320-2882
Silver nanoparticles (AgNPs) was synthesized from lemongrass extract, where lemongrass was dried and powdered. Then were soaked in sterile distilled water and boiled for 20minutes and filtered. The filtrate was employed for the synthesis of silver nanoparticles. The extract was coated to scripted Palm Leaf Manuscripts and observed for few months keeping one Palm Leaf Manuscripts as control without coating with the sample. In this study, lemongrass extract was successfully used to biologically synthesize AgNPs. In order to protect the PLM from harm and preserve it for both present and future use, preservation and conservation are related. Since it is nearly difficult to restore the old original manuscripts to their original state, they must be preserved. The knowledge concealed within the original documents will give research and development a new perspective. According to 'Constitution of India - 1950, In Part IV-A under fundamental Duties in article 51A "It shall be the duty of every citizen of India-point no. (f) to value and preserve the rich heritage of our composite culture." (Govt. of India,2015.). Therefore, its everyone duty is to preserve the heritage of India by preserving the PLMs.
Licence: creative commons attribution 4.0
Nanoparticles, Lemongrass, Palm leaves, Aspergillus, Fusarium.
Paper Title: The politics of allegory:A Satirical Strategies in John Dryden's Absalom and Achitophel
Author Name(s): JONNADA RAMBABU
Published Paper ID: - IJCRT2509349
Register Paper ID - 293611
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509349 and DOI :
Author Country : Indian Author, India, 533228 , vanapalli, 533228 , | Research Area: Languages Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509349 Published Paper PDF: download.php?file=IJCRT2509349 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509349.pdf
Title: THE POLITICS OF ALLEGORY:A SATIRICAL STRATEGIES IN JOHN DRYDEN'S ABSALOM AND ACHITOPHEL
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Languages
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d60-d62
Year: September 2025
Downloads: 120
E-ISSN Number: 2320-2882
This paper investigates John Dryden's Absalom and Achitophel (1681) as a work of political satire that fuses biblical allegory with Restoration political conflicts. While critics have long recognized Dryden's skill as a satirist, relatively fewer studies emphasize how allegorical representation functions as a political weapon to consolidate monarchical power. Through a close reading of the text and engagement with critical scholarship, this study analyzes Dryden's satirical strategies in portraying the Earl of Shaftesbury (Achitophel) and the Duke of Monmouth (Absalom). The paper employs a New Historicist framework to situate the poem within its political and cultural context, demonstrating that Dryden's satire reflects not only personal wit but also institutional ideology. Ultimately, the study argues that Absalom and Ahithophel exemplifies satire's dual role as a literary art form and as a persuasive tool of political propaganda in Restoration England.
Licence: creative commons attribution 4.0
Restoration Literature,John Dryden,Satire,Allegory,Political Poetry
Paper Title: In Silico Discovery of Potential Polycystic Kidney Disease Protein Vasopressin V2 Inhibitors: A Structure-Based Approach Leveraging Tolvaptan-Derived Similarity and Blind Docking
Author Name(s): Mr. Jagdish S. Belekar, Ms. Sneha N. Patil, Mr. Dhairyashil R. Deshmukh, Mr. Sangram S. Salgar, Mrs. Tejashree S. Khamkar
Published Paper ID: - IJCRT2509348
Register Paper ID - 293824
Publisher Journal Name: IJPUBLICATION, IJCRT
DOI Member ID: 10.6084/m9.doi.one.IJCRT2509348 and DOI :
Author Country : Indian Author, India, 416112 , Peth vadgaon, 416112 , | Research Area: Pharmacy All Published Paper URL: http://ijcrt.org/viewfull.php?&p_id=IJCRT2509348 Published Paper PDF: download.php?file=IJCRT2509348 Published Paper PDF: http://www.ijcrt.org/papers/IJCRT2509348.pdf
Title: IN SILICO DISCOVERY OF POTENTIAL POLYCYSTIC KIDNEY DISEASE PROTEIN VASOPRESSIN V2 INHIBITORS: A STRUCTURE-BASED APPROACH LEVERAGING TOLVAPTAN-DERIVED SIMILARITY AND BLIND DOCKING
DOI (Digital Object Identifier) :
Pubished in Volume: 13 | Issue: 9 | Year: September 2025
Publisher Name : IJCRT | www.ijcrt.org | ISSN : 2320-2882
Subject Area: Pharmacy All
Author type: Indian Author
Pubished in Volume: 13
Issue: 9
Pages: d49-d59
Year: September 2025
Downloads: 101
E-ISSN Number: 2320-2882
Vasopressin V2 receptor (V2R) Autosomal Dominant Polycystic Kidney Disease (ADPKD) is closely linked with dysregulation of the vasopressin V2 receptor (V2R), and is hence a drug target. A general computational strategy of pharmacophore-guided virtual screening and structure-based molecular docking was utilized in this study to identify potential V2R modulators. The crystal structure of the human vasopressin V2 receptor (PDB ID: 6U1N) was validated and used as the target model. A 3-point pharmacophore model was constructed with Tolvaptan--a well-known V2R antagonist--as a reference, which includes important interaction features such as hydrogen bond donors/acceptors and hydrophobic cavities. A filtered group of compounds from the Zinc Drug database was further assessed with molecular docking using AutoDock Vina and CB-Dock. In the top contenders, CHEBI:130604 scored the highest binding energy with a Vina score of -10.0 kcal/mol, surpassing Tolvaptan (Vina score -9.7 kcal/mol). Other contenders were CHEBI:127778 (-9.1 kcal/mol), CHEBI:128672 (-8.4 kcal/mol), and CHEBI:125791 (-8.4 kcal/mol). Analysis of the V2R pocket showed large cavities, with Pocket C1 (volume: 9069 ?) and Pocket C5 (volume: 557 ?) being principal binding hotspots. The repeated interaction of high-affinity ligands to these pockets suggests their key role in ligand recognition and receptor modulation. These findings provide new candidate molecules with more favorable binding profiles than Tolvaptan and offer promising leads to the development of selective V2R antagonists for the therapy of ADPKD.
Licence: creative commons attribution 4.0
ADPKD; Vasopressin V2 Receptor; Tolvaptan; Pharmacophore Modeling; Molecular Docking; Virtual Screening; Auto Dock Vina; CB-Dock; Binding Affinity; Drug Discovery; CHEBI:130604

