| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 22PIM3713 | Abhaya Ranjan Sahoo | Identification of Potential Therapeutic Target in Breast cancer using Network based method | 
| 22PIM3715 | Bhavya | Protein degradation of undruggabletarget: molecular design of selective protein degraders for PTP1B | 
| 22PIM3717 | Chatla Meghana | In sillicostudies to identify dual inhibitors for SGLT1 and SGLT2 using the Scaffold Hoping Method | 
| 22PIM3723 | Kushwaha Sandhya Lalbabu | Prediction of 3D structure of Therapeutic targets for Mucormycosis (Black Fungus) using AlfaFold | 
| 22PIM3724 | Om Dharmshyam Patle | Molecular Glue for RNA binding Motif protein 39 using Computer Aided Molecular Design for Cancer therapy | 
| 22PIM3726 | Raut Vruksha Arvind | Computational study to identify less Haemotoxic Beta-V Specific Covalent Microtubule inhibitor Against NSCLC | 
| 22PIM3728 | Satharla Mojesh | A computational approach for the rational design of TrKA kinase inhibitors for the treatment of ameloiblastoma | 
| 22PIM3729 | Singh Alka Arvind | Unraveling the conformational dynamics of IDH mutants throughsteered MolecularDynamic Simulation | 
| 22PIM3731 | Tshering Lhaden Bhutia | To design high-affinity nanobodies to target SARS-CoV-2 spike protein using a rational mutational approach | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 21PIM3479 | Ankita | Computer aided design of peptidomimetics against Mpro protein of SARS-CoV-2 | 
| 21PIM3481 | Bommana Pavani | 3D structure prediction and molecular modeling studies on therapeutic targets involved in opportunistic infections | 
| 21PIM3482 | Deepesh Kumar Patel | Structure-based design of covalent inhibitors for PLpro target of Sars-CoV-2 | 
| 21PIM3483 | Dhriti Kaushik | Updation of developed PROTAC database and in silico targeted degradation of microtubules | 
| 21PIM3485 | Gandhe Akshata Santosh | Computer aided molecular design of FXR Agonists for the treatment of NASH | 
| 21PIM3486 | Harish Kumar | Computational Study from Genome to Hit molecule for Influenza Virus | 
| 21PIM3487 | Jethender Jain R | Off-target prediction using Machine Learning | 
| 21PIM3491 | Moyim Mallick | Computational study of protein-protein interaction and design of peptide mimetics for TrkA in ameloblastoma | 
| 21PIM3492 | Mridula Moudgil | An indirect approach to inhibit the CD47-SIRPalpha interaction: A Computational Study | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 20PIM3265 | Anjali Kainth | Structure Based Studies of Transmembrane Serine Protease 2 for SARS-CoV-2 | 
| 20PIM3269 | Kalyani Pillala | Development of a Database on PROTACs | 
| 20PIM3271 | Mahima Gajanan Narvekar | QSTR studies for the prediction of GLP compliant toxicity | 
| 20PIM3273 | Satyendra Kailas Agale | To develop the QSAR model for Ddn (deazaflavin-dependent nitro reductase) inhibitors | 
| 20PIM3274 | Shakira Abdul | Predicting 3D structure of potential therapeutic targets in life style diseases | 
| 20PIM3278 | Swathi Nadendla | Computer Aided Design of Peptidomimetics and Foldamers Against Spike Protein of SARS-CoV-2 | 
| 20PIM3279 | Vaishnavi Namala | In silico Designing of PARP1 Protein Degraders for TNBC Targeted Therapy | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 19PIM3058 | Aayushi Sharma | Repurposing Of Drugs For Corona viruses Mers-Cov, SARS-Cov, SARS-Cov-2 Using In Silico Approaches | 
| 19PIM3065 | Muhammed Shaheer A.P. | In Silico Designing Of PARP1 Protein Degraders For TNBC Targeted Therapy | 
| 19PIM3066 | Nishandar Nikhita Balaso | Computer Aided Design Of Peptide And Peptidomimetics For S1 Protein Of SARS-Cov-2 | 
| 19PIM3067 | Pragya Mishra | Computer-Aided Molecular Design Of Novel D2 & 5-HT2A Antagonist For The Treatment Of Schizophrenia | 
| 19PIM3068 | Prashant Raghuwanshi | Structure Based Design Of CCR5 Antagonists As Potential Molecule For Nash | 
| 19PIM3071 | Shenvi Kudchadker Gayatri Vinay | Structure Prediction Of Transmembrane Protease Serine 2 And Designing Of Its Inhibitors For SARS-Cov-2 | 
| 19PIM3072 | Singh Ravi | Design Of Novel Inhibitors For The Mutated Deazaflavin Dependent Nitro-Reductase Using Computational Tools | 
| 19PIM3074 | Vaishnavi | Combating Sars-Cov-2 By Targeting Rdrp, The Key Virus Enzyme Using In Silico Approaches | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 18PIM2855 | Alichy Sowmya | Ebola Virus: Structural Prediction of L Protein And Its Inhibitors | 
| 18PIM2857 | Gudea Jaya Krishna | Computational Studies to Explore Mtb DNA Gyrase B Dimerization | 
| 18PIM2858 | Gundaboina Shalini | An in silico Study of Mutation on Glucokinase (GCK) for onset Diabetes of the Young (MODY) | 
| 18PIM2859 | Harish Kumar | Role of mTOR in Cancer Metabolism : A Computational Study | 
| 18PIM2860 | Laddha Kapil Sunil | QSAR Study on GSK-3 Beta Inhibitors | 
| 18PIM2862 | Nilanjan Samanta | Computational Approaches To Design Protein Degraders for Treating Type 2 Diabetes Mellitus | 
| 18PIM2864 | Prajapati Parth Ajay | Role of CD73 in Cancer: A Computational Study | 
| 18PIM2869 | Sonia Kumari | Computer Aided Molecular Design of CCR2 - CCR5 Dual Antagonist for NASH | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 17PIM2665 | Antara Rani Mallick | Design of potential inhibitors against malate synthase as antituberculosis agents | 
| 17PIM2668 | Devarakonda Sindhuja | Development of QSTR model for the prediction of hepatotoxicity | 
| 17PIM2670 | Gera Narendra | Novel computational strategies to identify potent small molecular Mtb DNA GyraseB ATPase inhibitors to explore MDR-TB | 
| 17PIM2671 | Harmanpreet Singh | Design of potential inhibitors against F1FO ATP synthase as anti-tubercular agents | 
| 17PIM2673 | Meenakshi Chaurasiya | Computer aided molecular design of beta-2 adrenergic agonists for bronchopulmonary dysplasia | 
| 17PIM2679 | Ullerao Kranthi Kumar | In silico drug designing for non-structural protein 5(NS5) of dengue virus | 
| 17PIM2680 | Vinay Baghel | Computer Aided Drug Design of AANAT enzyme inhibitors to regulate circadian rhythm | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 16PIM2458 | Ajeet Kumar Singh | Computer Aided Molecular Design of Quorum Sensing Inhibitors for Pseudomonas aeruginosa Biofilm | 
| 16PIM2461 | Donempudi Sunil Chand | Identification of a Putative Binding Site for Diospyrin on DNA Gyrase | 
| 16PIM2465 | Merugu Sattibabu | Design of Potential Dipeptidyl Peptidase-4 (DPP-4) Inhibitor for Type-2 Diabetes Based on 3D-QSAR Studies | 
| 16PIM2466 | Monica Singh | An in silico study to explore allosteric sites in proteins | 
| 16PIM2469 | Ravi Kumar | An in silico Study to Explore the Role of Foldamers in PTP1B-EGFR Interactions | 
| 16PIM2471 | Sandeep | Design of Anti-CD47 Molecules using in silico approaches | 
| 16PIM2475 | Sul Komal Uttam | Computational Design of the Anti HIV Molecule - Anibamine as Anti Prostate Cancer Agents | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 15PIM2239 | Erra Prathima | Study of structurally disordered regions in kinase proteins using computational methods | 
| 15PIM2240 | Gayathri K K | Identification of potent inhibitors targeting Ebola virus VP40 protein: A computational study | 
| 15PIM2241 | Geethu C R | in silico Design Of Dual Inhibitors For Icam-1 And Icam-4: Target For Tuberculosis And Malaria | 
| 15PIM2245 | Nandan Shyam Sharma | Computer aided design of potential small molecule agonists of GLP-1R | 
| 15PIM2250 | Sachin Vishwakarma | Design of potential inhibitor against Malate Synthase as antituberculosis agent | 
| 15PIM2252 | Sruthy S Raj | in silico Analysis of Hk Ii As Anticancer Target And Investigation Into Acidic Tumour Microenvironment | 
| 15PIM2253 | Sunil Kushwah | To design potential inhibitors of NHE1using in silico techniques | 
| 15PIM2255 | Umesh Chandra Yadav | 3D-QSAR study on microbacterial ATP Synthase inhibitors | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 14PIM2050 | Bairumalla Laxmi Praveen | A computational study to identify potential VP35 inhibitors for Ebola Virus | 
| 14PIM2056 | Smrithi Radhakrishnan | An in silico approach for Epitope based vaccine design against Ebola virus | 
| 14PIM2057 | Sunam Kumari | Design of potential inhibitor as an Antitubercular agent against Isocitrate Lyase using in silico approaches | 
| 14PIM2059 | Thati Manoj Nag | Molecular capsules for enhancing the solubility and bioavailability of drug molecules using in silico approaches | 
| 14PIM2061 | Tukesh Ram Sahu | Computational analysis of the Metabolic network of Mycobacterium tuberculosis, to detect potential drug target | 
| 14PIM2062 | Vivek Giri Goswami | Computational screening and identification of bioactive phytochemicals against NS5B polymerase of HCV | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 13PIM1835 | Bhukya Asha | Rescuing and Repurposing of Drugs for cancer | 
| 13PIM1842 | Mayura Borgaonkar | Identification of INHA Homology to Design Multi Target Ligand | 
| 13PIM1843 | Mohammad Rizwan | CD47 Targetted AntibodyTherapy : A Molecular Modelling Study of anti-CD47 antibodies interactions | 
| 13PIM1844 | Namani Kranthikumar | Computational Analysis of the Metabolic Networks of H.pylori to Detect Potential Drug Targets | 
| 13PIM1846 | Sivangula Srikanth | Quantitative Structure Activity Relationship and Selectivity Studies on PTP1B Allosteric Inhibitors | 
| 13PIM1848 | Tg Babu Rajendraprasad | Dimerization of CCR2 Receptor: Insights from Computational Modeling | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 12PIM1637 | Abdul Wahid Khan | The elucidation of binding site of Calreticulin on LRP1 and binding mechanism of full length Calreticulin | 
| 12PIM1641 | Kancharla Ramya Deepika | Structure based inhibitor selectivity of Leishmania donovani HMG-CoA-Reductase (LdHMGR) | 
| 12PIM1642 | Konduru Guruprasad Varma | Study of intrinsically disordered proteins using computational approach | 
| 12PIM1650 | Parikh Rutul Janakkumar | Design of selective Mycobacterium GigE pathway inhibitors using insilicoapproach | 
| 12PIM1651 | Patil Ujwalkumar Premsukh | Rational de novo design of PKC-ßII inhibitors based on its Allosteric Inhibition Mechanism | 
| 12PIM1655 | Rosiamliana Colney | Characterization of novel allosteric site of PTP1B and its implication in inhibitor design | 
| 12PIM1657 | Sapna Rani | Homology Modeling of Human CXCR2 receptor and design of dual inhibitors of Chemokine receptors CXCR1 and CXCR2 using Pharmacophore mapping approach | 
| 12PIM1660 | Vyas Palak Ashvinkumar | Comparative Molecular Docking Study of Neuraminidase with its Antibody and Inhibitors | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2011/XIV/1419/MP | Alekhya Kokkula | Study of conformational behavior of PKC-ßII in the presence of ATP | 
| PI/2011/XIV/1420/MP | Ankit Geete | Effects of dimerization on the conformation of Chemokinase Receptor2 (CCR2) | 
| PI/2011/XIV/1424/MP | Golla Vinaya Kumar | Computational study of isoniazid resistance: A comparative binding affinity approach | 
| PI/2011/XIV/1426/MP | Kesireddy Anusha Reddy | Computational study of ligand induced changes in the binding cavity of ALR2 | 
| PI/2011/XIV/1427/MP | Kiranmai Ganji | BIOMARKER Database | 
| PI/2011/XIV/1429/MP | Makadia Nayana Jeevanlal | Elucidation of the binding mechanism of full length PTP1B | 
| PI/2011/XIV/1436/MP | Poornima Srinivasan Iyer | Insilico approaches to characterize open and closed conformation of DHBPS enzyme | 
| PI/2011/XIV/1442/MP | Thapaswini Parvatham | Comparative binding mode analysis of Laninamivir with H1N1 Neuraminidase and its Antibody Complex | 
| PI/2011/XIV/1443/MP | Venkatakrishnan Ramaswamy | An insight into the effect of pH and temperature on CD47 domain swapping: A molecular dynamics approach | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2010/XIII/1131/MP | Mrudula Potluri | MD Simulation Studies on Mycobacterial 3,4-Dihydroxy-2-butanone-4-phosphate synthase | 
| PI/2010/XIII/1134/MP | Bhayye Sagar Santaram | Studies on Aldose reductase 2 (ALR2) inhibitors in diabetic complications | 
| PI/2010/XIII/1136/MP | Jahnavi Bolla | in silico Guided Identification and Validation of Targets for a Novel Scaffold, 2-Thiazolylimino-5-benzylidene-thiazolidin-4-one | 
| PI/2010/XIII/1139/MP | Karunakar Reddy Pothula | Role of CD47 as therapeutic target in cancer | 
| PI/2010/XIII/1141/MP | Anand Balupuri | Role of CCR2 in Inflammation-driven Diseases | 
| PI/2010/XIII/1143/MP | Jyoti | in silico Studies on Neuraminidase Inhibitors | 
| PI/2010/XIII/1144/MP | Venkatesh G. | Molecular docking studies on Enoyl reductase, a potential targer for Tuberculosis | 
| PI/2010/XIII/1151/MP | Vijendra Kumar Malav | in silico Studies on BCS Class II Drugs: Effect of Solubility and Permeability | 
| PI/2010/XIII/1152/MP | Bhat Jyotsna Shahaji | Molecular Dynamics Study of Protein Kinase C-ßII | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2009/XII/936/MP | Prajapati Jignesh Kkumardahyabhai | Structure based design of selective aldose reductase inhibitors | 
| PI/2009/XII/941/MP | Raut Avnikumari Uttambhai | Computer aided molecular design of dual inhibitors of PTP1B and PTPLAR | 
| PI/2009/XII/943/MP | Shinde Pravin Vishnu | Structure based design of 3,4-dihydroxy-2-butanone-4-phosphate synthase inhibitors | 
| PI/2009/XII/944/MP | Shirishkumar Pawar | Homology structure based pharmacophore studies on CCR2B receptor | 
| PI/2009/XII/945/MP | Shishir Rohit | Computer aided molecular design of protein kinase C-beta II | 
| PI/2009/XII/948/MP | Vijay Singh | Comparative molecular dynamics study to probe the resistance of oseltamivir towards neuraminidase | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2008/XI/781/MP | Chavan Swapnil Shivaji | in silico mutagenesis studies on Chemokine Receptor 2 (CCR2) | 
| PI/2008/XI/784/MP | Shah Anup Dileep | Computer Aided Molecular Design of Selective Aldose Reductase Inhibitors | 
| PI/2008/XI/785/MP | Gangwal Rahul Prakash | Design and development of a QSAR software | 
| PI/2008/XI/789/MP | Kare Pavan Tanaji | Structure based design of Mono Amino Oxidase B inhibitors for Parkinson’s disease | 
| PI/2008/XI/790/MP | Kapil Jain | From Peptides to Structure Based Drug Design: An in silico Approach for PKC-ß II Inhibition | 
| PI/2008/XI/795/MP | Dara Ajay | Fragment based design of Protein Tyrosine Phosphatase (PTP)A and LAR | 
| PI/2008/XI/798/MP | V. Hymavathi | Role of water in human Aldose Reductase2: A Molecular Dynamics Approach | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2007/X/648/MP | Hirdesh Kumar | in silico re-optimization of anti-diabetic agents | 
| PI/2007/X/652/MP | Rajendra Kumar | Steered and Targeted Molecular Dynamics Studies on PTP1B Inhibitor Complex | 
| PI/2007/X/655/MP | Sudha Kumari Rajgadia | Homology modeling of P-glycoprotein and exploration of its binding mechanism | 
| PI/2007/X/656/MP | Pillutla Sri Divya | From Peptides to Peptidomimetics: Design of PKCßII Inhibitors | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2006/IX/539/MP | K. Srikanth | MI-QSAR and HQSAR Analysis: Application to The Prediction of Oral Drug Absorption | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2005/VIII/455/MP | Nair Pramod Chandrasekharan | Comparative QSTR studies for predicting Mutagenicity of Nitro Compounds | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 17PIP460 | Ketan Ghosh | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 16PIP441 | Sivangula Srikanth | Identification of Potential Pan Inhibitors for mutants of Isocitrate dehydrogenase (IDH) 1 and 2 as Anti-Cancer Agents: Insights from Computational Studies | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| 15PIP426 | G Siva Kumar | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2010/XVIII/278/P | Vivek Kumar | Computer-Aided Molecular Design of InhA Inhibitors for Tuberculosis | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2008/XVI/210/P | Shinde Ranajit Nivrutti | Computer Aided Design of Protein Tyrosine Phosphate-1B Allosteric Inhibitors | 
| PI/2008/XVI/212/P | Baljinder Kaur Grewal | Computer Aided Drug Design of Protein Kinase Beta-II | 
| Reg. No. | Name | Thesis Title | 
|---|---|---|
| PI/2008/XVI/209/P | Rajesh Singh | Probing the Mechanism of Inflammatory Driven Diseases and Computer Aided Drug Design of small CCR-2 Antagonists |