All Stories

  1. Model for prediction of MRP-2 inhibition

    Article • Combinatorial Chemistry & High Throughput Screening, December 2018, Bentham Science Publishers

    Professor Prabha Garg, Sahil Kharangarh, Hardeep Sandhu

  2. HToPred: A Tool for Human Topoisomerase II Inhibitor Prediction

    Article • Molecular Informatics, September 2018, Wiley

    Professor Prabha Garg

  3. Characterization of forced degradation products of canagliflozine by liquid chromatography/quadrupole time-of-flight tandem mass spectrometry and in silico toxicity predictions

    Article • Rapid Communications in Mass Spectrometry, January 2018, Wiley

    Professor Prabha Garg, Dr M.V.N Kumar Talluri

  4. Identification and characterization of vilazodone metabolites in rats and microsomes by ultrahigh-performance liquid chromatography/quadrupole time-of-flight tandem mass spectrometry

    Article • Rapid Communications in Mass Spectrometry, October 2017, Wiley

    Professor Prabha Garg, Dr M.V.N Kumar Talluri

  5. Identification and characterization of fluvastatin metabolites in rats by UHPLC/Q-TOF/MS/MS and in silico toxicological screening of the metabolites

    Article • Journal of Mass Spectrometry, May 2017, Wiley

    Professor Prabha Garg, Dr SRINIVAS RAGAMPETA, Dr M.V.N Kumar Talluri

  6. Biological Evaluation of Small Molecule Inhibitors of Mtb-ASADH Enzyme

    Article • Letters in Drug Design & Discovery, June 2016, Bentham Science Publishers

    Professor Prabha Garg

  7. An improved approach for predicting drug–target interaction: proteochemometrics to molecular docking

    Article • Molecular BioSystems, January 2016, Royal Society of Chemistry

    Professor Prabha Garg

  8. Liquid Chromatographic Method Development for Forced Degradation Products of Dabigatran Etexilate: Characterisation and In Silico Toxicity Evaluation

    Article • Chromatographia, December 2015, Springer Science + Business Media

    Professor Prabha Garg

  9. Computational Approaches for Enzyme Functional Class Prediction: A Review

    Article • Current Proteomics, November 2015, Bentham Science Publishers

    Professor Prabha Garg

  10. Rapid structural characterization ofin vivoandin vitrometabolites of tinoridine using UHPLC-QTOF-MS/MS andin silicotoxicological screening of its metabolites

    Article • Journal of Mass Spectrometry, September 2015, Wiley

    Dr M.V.N Kumar Talluri, Professor Prabha Garg

  11. Classification of Breast Cancer Resistant Protein (BCRP) Inhibitors and Non-Inhibitors Using Machine Learning Approaches

    Article • Combinatorial Chemistry & High Throughput Screening, July 2015, Bentham Science Publishers

    Professor Prabha Garg

  12. Characterization of forced degradation products of pazopanib hydrochloride by UHPLC-Q-TOF/MS andin silicotoxicity prediction

    Article • Journal of Mass Spectrometry, June 2015, Wiley

    Professor Prabha Garg

  13. Molecular Mechanism of Poly(vinyl alcohol) Mediated Prevention of Aggregation and Stabilization of Insulin in Nanoparticles

    Article • Molecular Pharmaceutics, April 2015, American Chemical Society (ACS)

    Professor Prabha Garg

  14. Pharmacoinformatics analysis to identify inhibitors ofMtb-ASADH

    Article • Journal of Biomolecular Structure and Dynamics, February 2015, Taylor & Francis

    Professor Prabha Garg

  15. Characterization of stress degradation products of mirabegron using UPLC-QTOF-MS/MS and in silico toxicity predictions of its degradation products

    Article • RSC Advances, January 2015, Royal Society of Chemistry

    Dr M.V.N Kumar Talluri, Professor Prabha Garg

  16. Characterization of stress degradation products of blonanserin by UPLC-QTOF-tandem mass spectrometry

    Article • RSC Advances, January 2015, Royal Society of Chemistry

    Dr M.V.N Kumar Talluri, Professor Prabha Garg

  17. Role of breast cancer resistance protein (BCRP) as active efflux transporter on blood-brain barrier (BBB) permeability

    Article • Molecular Diversity, December 2014, Springer Science + Business Media

    Professor Prabha Garg

  18. Development of [ 18 F]-Labeled Pyrazolo[4,3- e ]-1,2,4- triazolo[1,5- c ]pyrimidine (SCH442416) Analogs for the Imaging of Cerebral Adenosine A 2A Receptors with Positron Emission Tomography

    Article • Journal of Medicinal Chemistry, August 2014, American Chemical Society (ACS)

    Professor Prabha Garg

  19. Computational Approaches for Enzyme Functional Class Prediction: A Review

    Article • Current Proteomics, July 2014, Bentham Science Publishers

    Professor Prabha Garg

  20. A comparative study of integrase-binding domain of homologous HRP2 and LEDGF/p75 protein: from sequence to structural characterisation

    Article • Molecular Simulation, July 2014, Taylor & Francis

    Professor Prabha Garg

  21. Shape-based virtual screening, docking, and molecular dynamics simulations to identifyMtb-ASADH inhibitors

    Article • Journal of Biomolecular Structure and Dynamics, June 2014, Taylor & Francis

    Professor Prabha Garg

  22. Insights into controlling role of substitution mutation, E315G on thermostability of a lipase cloned from metagenome of hot spring soil

    Article • 3 Biotech, June 2013, Springer Science + Business Media

    Professor Prabha Garg

  23. Molecular Modeling and Active Site Binding Mode Characterization of Aspartate β-Semialdehyde Dehydrogenase Family

    Article • Molecular Informatics, April 2013, Wiley

    Professor Prabha Garg

  24. QSAR Study of Curcumine Derivatives as HIV-1 Integrase Inhibitors

    Article • Current Computer - Aided Drug Design, March 2013, Bentham Science Publishers

    Professor Prabha Garg

  25. In silico screening for identification of novel HIV-1 integrase inhibitors using QSAR and docking methodologies

    Article • Medicinal Chemistry Research, February 2013, Springer Science + Business Media

    Professor Prabha Garg

  26. QSAR Study of Curcumine Derivatives as HIV-1 Integrase Inhibitors

    Article • Current Computer - Aided Drug Design, January 2013, Bentham Science Publishers

    Professor Prabha Garg

  27. High-throughput virtual screening of phloroglucinol derivatives against HIV-reverse transcriptase

    Article • Molecular Diversity, January 2013, Springer Science + Business Media

    Professor Prabha Garg

  28. Cystathionineβ-Lyase-Like Protein with Pyridoxal Binding Domain Characterized inLeishmania majorby Comparative Sequence Analysis and Homology Modelling

    Article • ISRN Computational Biology, January 2013, Hindawi Publishing Corporation

    Professor Prabha Garg

  29. Identification of Novel HIV-1 Integrase Inhibitors Using Shape-Based Screening, QSAR, and Docking Approach

    Article • Chemical Biology & Drug Design, February 2012, Wiley

    Professor Prabha Garg

  30. Prediction of drug-resistance in HIV-1 subtype C based on protease sequences from ART naive and first-line treatment failures in North India using genotypic and docking analysis

    Article • Antiviral Research, November 2011, Elsevier

    Dr Aman Sharma, Professor Prabha Garg

  31. Comparative docking and CoMFA analysis of curcumine derivatives as HIV-1 integrase inhibitors

    Article • Molecular Diversity, February 2011, Springer Science + Business Media

    Professor Prabha Garg

  32. Design and synthesis of caffeoyl-anilides as portmanteau inhibitors of HIV-1 integrase and CCR5

    Article • Bioorganic & Medicinal Chemistry, February 2011, Elsevier

    Professor Prabha Garg

  33. Active site binding interactions of β-carboline derivative for HIV reverse transcriptase, protease and integrase

    Article • International Journal of Drug Discovery, December 2010, Bioinfo Publications

    Professor Prabha Garg

  34. Active site binding modes of dimeric phloroglucinols for HIV-1 reverse transcriptase, protease and integrase

    Article • Bioorganic & Medicinal Chemistry Letters, August 2010, Elsevier

    Professor Prabha Garg

  35. Synthesis and Antileishmanial activity of Piperoyl-Amino Acid Conjugates

    Article • European Journal of Medicinal Chemistry, August 2010, Elsevier

    Professor Prabha Garg

  36. Docking-based 3D-QSAR study of HIV-1 integrase inhibitors

    Article • European Journal of Medicinal Chemistry, November 2009, Elsevier

    Professor Prabha Garg

  37. 3D-QSAR studies of substituted 1-(3, 3-diphenylpropyl)-piperidinyl amides and ureas as CCR5 receptor antagonists

    Article • Journal of Molecular Modeling, February 2007, Springer Science + Business Media

    Professor Prabha Garg

  38. In Silico Prediction of Blood Brain Barrier Permeability:  An Artificial Neural Network Model

    Article • Journal of Chemical Information and Computer Sciences, January 2006, American Chemical Society (ACS)

    Professor Prabha Garg

  39. In Silico Modeling for Blood—Brain Barrier Permeability Predictions

    Article • Springer Science + Business Media

    Professor Prabha Garg