In silico Prediction, Characterization, Molecular Docking and Dynamic Studies on Fungal SDRs as Novel Targets for Searching Potential Fungicides against Fusarium Wilt in Tomato. M Aamir, VK Singh, MK Dubey, M Meena, SP KASHYAP, SK Katari, ... Frontiers in Pharmacology 9, 1038, 2018 | 110 | 2018 |
Inhibitor design against JNK1 through e-pharmacophore modeling docking and molecular dynamics simulations SK Katari, P Natarajan, S Swargam, H Kanipakam, C Pasala, ... Journal of Receptors and Signal Transduction 36 (6), 558-571, 2016 | 59 | 2016 |
In silico exploration of lignin peroxidase for unraveling the degradation mechanism employing lignin model compounds AK Singh, SK Katari, A Umamaheswari, A Raj RSC Advances 11, 14632–14653, 2021 | 28 | 2021 |
An in silico study: Novel targets for potential drug and vaccine design against drug resistant H. pylori C Pasala, CSR Chilamakuri, SK Katari, RM Nalamolu, RB Aparna, ... Microbial Pathogenesis 122, 156-161, 2018 | 24 | 2018 |
197 Combination of e-pharmacophore modeling, multiple docking strategies and molecular dynamic simulations to discover of novel antagonists of BACE1 N Pradeep, M Munikumar, S Swargam, K Hema, K Sudheer Kumar, ... Journal of Biomolecular Structure and Dynamics 33 (sup1), 129-130, 2015 | 20 | 2015 |
Epitope-driven common subunit vaccine design against H. pylori strains C Pasala, CSR Chilamakuri, SK Katari, RM Nalamolu, AR Bitla, ... Journal of Biomolecular Structure and Dynamics, 2018 | 16 | 2018 |
Hierarchical-Clustering, Scaffold-Mining Exercises and Dynamics Simulations for Effectual Inhibitors Against Lipid-A Biosynthesis of Helicobacter pylori C Pasala, SK Katari, RM Nalamolu, AR Bitla, U Amineni Cellular and Molecular Bioengineering 12, 255-274, 2019 | 12 | 2019 |
Inhibitor Design for VacA Toxin of Helicobacter pylori P Chiranjeevi, S Swargam, N Pradeep, K Hema, KS Kumar, RM Nalamolu J Proteomics Bioinform 9, 220-225, 2016 | 12 | 2016 |
Pathophysiology of matrix metalloproteinases in breast cancer progression SK Katari, C Pasala, RM Nalamolu, UN Vankadoth, SP Alexander, ... Journal of Clinical and Scientific Research| Volume 8 (3), 2019 | 11 | 2019 |
E-pharmacophore model assisted discovery of novel antagonists of nNOS NR Madhulitha, N Pradeep, S Sandeep, K Hema, P Chiranjeevi Biochem Anal Biochem 6 (307), 2161-1009.1000307, 2017 | 10 | 2017 |
Novel and potent inhibitors for dihydropteroate synthase of Helicobacter pylori SH Satuluri, SK Katari, C Pasala, U Amineni Journal of Receptors and Signal Transduction 40 (3), 246-256, 2020 | 9 | 2020 |
In silico probing exercises, bioactive-conformational and dynamic simulations strategies for designing and promoting selective therapeutics against Helicobacter … C Pasala, SK Katari, RM Nalamolu, AR Bitla, U Amineni Journal of Molecular Graphics and Modeling 93, 2019 | 6 | 2019 |
Design of Novel Antimycobacterial Molecule Targeting Shikimate Pathway of Mycobacterium tuberculosis P SivaRanjani, V Umakanth Naik, N Ravina Madhulitha, ... Indian Journal of Pharmaceutical Sciences 81 (3), 438-447, 2019 | 6 | 2019 |
Discovery of Common Putative Drug Targets and Vaccine Candidates for Mycobacterium tuberculosis sp. RM Nalamolu, C Pasala, SK Katari, U Amineni Journal of Drug Delivery & Therapeutics 9 (2-S), 67-71, 2019 | 6 | 2019 |
Synthesis, Biological Evaluation and Docking Studies of N-(2-benzamido feruloyl) Aryl Hydrazone Analogues M Soujanya, G Rajitha, A Umamaheswari, K Sudheer Kumar Letters in Drug Design & Discovery 15 (8), 875-886, 2018 | 6 | 2018 |
In silico trials to design potent inhibitors against matrilysin (MMP-7) SK Katari, C Pasala, RM Nalamolu, B Aparna R., U Amineni Journal of Biomolecular Structure and Dynamics 40 (22), 11851-11862, 2021 | 5 | 2021 |
Integration of core hopping, quantum-mechanics, molecular mechanics coupled binding-energy estimations and dynamic simulations for fragment-based novel therapeutic scaffolds … C Pasala, SK Katari, RM Nalamolu, RB Aparna, U Amineni Computational biology and chemistry 83, 107126, 2019 | 5 | 2019 |
Analgesic activity of Alpinia galanga extract in mice models and TNF-alpha receptor computational docking analysis on its leads with pharmacokinetics prediction KR Subash, G Francis Britto, K Sudheer Kumar, A Umamaheswari, ... International Journal of Basic & Clinical Pharmacology 7 (3), 446-450, 2018 | 5 | 2018 |
Synthesis, molecular docking studies and antimicrobial activity of substituted cinnamides K Saritha, G Rajitha, K Sudheer Kumar, A Umamaheswari International Journal of Pharmacy and Biological Sciences 8 (3), 770-778, 2018 | 4 | 2018 |
In Silico Insights into the Arsenic Binding Mechanism Deploying Application of Computational Biology-Based Toolsets I Ahmad, AK Singh, S Mohd, SK Katari, RM Nalamolu, A Ahmad, ... ACS omega, 2024 | 3 | 2024 |