All Stories

  1. Molecular insights into the role of Estrogen Receptor Beta in Ecdysterone Mediated Anabolic Activity

    Article • PLOS One, June 2025, PLOS

    Prof. Zaheer Ul-Haq

  2. Frontiers in Computational Chemistry: Volume 6

    Article • September 2022, Bentham Science Publishers

    Prof. Zaheer Ul-Haq

  3. Effects of Smokeless Tobacco Samples from Tabuk Saudi Arabia on Nitric Oxide Production: A Potential Risk for Cancer and Cardiovascular Diseases

    Article • Current Computer - Aided Drug Design, April 2022, Bentham Science Publishers

    Miss Maria Saeed, Prof. Zaheer Ul-Haq, Izzaddinn Ahmed

  4. Exploiting Dengue Virus Protease as a Therapeutic Target: Current Status, Challenges and Future Avenues

    Article • Current Medicinal Chemistry, November 2021, Bentham Science Publishers

    Prof. Zaheer Ul-Haq

  5. Site-directed Fragnomics and MD Simulations Approaches to Identify Interleukin- 2 Inhibitors

    Article • Medicinal Chemistry, November 2020, Bentham Science Publishers

    Ruqaiya Khalil, Prof. Zaheer Ul-Haq

  6. Exploring the Molecular Mechanisms of 17β-HSD5-induced Carcinogenicity of Catha Edulis via Molecular Modeling Approach.

    Article • Medicinal Chemistry, October 2020, Bentham Science Publishers

    Prof. Zaheer Ul-Haq, Miss Maria Saeed

  7. Frontiers in Computational Chemistry: Volume 5

    Article • September 2020, Bentham Science Publishers

    Prof. Zaheer Ul-Haq

  8. Synthesis of Novel 8-Hydroxyquinoline Derivatives through Mannich Reaction and their Biological Evaluation as Potential Immunomodulatory Agents

    Article • Medicinal Chemistry, May 2020, Bentham Science Publishers

    Almas Jabeen, sobia halim, Prof. Zaheer Ul-Haq

  9. Computational Overview of Mycobacterial Thymidine Monophosphate Kinase

    Article • Current Pharmaceutical Design, May 2020, Bentham Science Publishers

    Prof. Zaheer Ul-Haq, Mohammad S. Mubarak, Ruqaiya Khalil

  10. Isolation of Cardamonin and Pinostrobin Chalcone from the Rhizomes of Boesenbergia rotunda (L.) Mansf. and their Cytotoxic Effects on H-29 and MDA-MB-231 Cancer Cell Lines

    Article • The Natural Products Journal, November 2019, Bentham Science Publishers

    Prof. Zaheer Ul-Haq, Sakina Shahabudin, Ruqaiya Khalil

  11. Characterization of cryptic allosteric site at IL-4Rα: New paradigm towards IL-4/IL-4R inhibition

    Article • International Journal of Biological Macromolecules, February 2019, Elsevier

    Prof. Zaheer Ul-Haq

  12. 2-Oxo-1,2,3,4-tetrahydropyrimidines Ethyl Esters as Potent β- Glucuronidase Inhibitors: One-pot Synthesis, In vitro and In silico Studies

    Article • Medicinal Chemistry, November 2018, Bentham Science Publishers

    Prof. Zaheer Ul-Haq, Muhammad Iqbal Choudhary

  13. Protein kinase A-dependent insulinotropic effect of selected flavonoids

    Article • International Journal of Biological Macromolecules, November 2018, Elsevier

    Prof. Zaheer Ul-Haq

  14. Molecular dynamics simulation of interleukin-2 and its complex and determination of the binding free energy

    Article • Molecular Simulation, September 2018, Taylor & Francis

    Syeda Rehana Zia, Prof. Zaheer Ul-Haq

  15. Catalytic asymmetric synthesis of indole derivatives as novel α -glucosidase inhibitors in vitro

    Article • Bioorganic Chemistry, September 2018, Elsevier

    Prof. Zaheer Ul-Haq

  16. Synthesis, and In Vitro and In Silico α-Glucosidase Inhibitory Studies of 5-Chloro-2-Aryl Benzo[d]thiazoles

    Article • Bioorganic Chemistry, August 2018, Elsevier

    Prof. Zaheer Ul-Haq

  17. Analyzing the Behavior of Neuronal Pathways in Alzheimer's Disease Using Petri Net Modeling Approach

    Article • Frontiers in Neuroinformatics, May 2018, Frontiers

    Prof. Zaheer Ul-Haq

  18. Bioactivity, Safety, and Efficacy of Amphotericin B Nanomicellar Aerosols Using Sodium Deoxycholate Sulfate as the Lipid Carrier

    Article • AAPS PharmSciTech, April 2018, American Association of Pharmaceutical Scientists (AAPS)

    Prof. Zaheer Ul-Haq

  19. Molecular dynamics simulations reveal structural insights into inhibitor binding modes and mechanism of casein kinase II inhibitors

    Article • Journal of Biomolecular Structure and Dynamics, March 2018, Taylor & Francis

    Dr. Majdi M. Bkhaitan, Prof. Zaheer Ul-Haq

  20. Computational and biological characterization of fusion proteins of two insecticidal proteins for control of insect pests

    Article • Scientific Reports, March 2018, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  21. Synthesis, antimicrobial activity, pharmacophore modeling and molecular docking studies of new pyrazole-dimedone hybrid architectures

    Article • Chemistry Central Journal, March 2018, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  22. Studies of Flavokawain B Type Chalcones and their Cytotoxic Effects

    Article • Molecules, March 2018, MDPI AG

    Prof. Zaheer Ul-Haq, Assoc. Prof. Dr. Syed Adnan Ali Shah, Dr Ching Kheng Quah

  23. Structural and Functional Characterization of RNA-binding Site of Rev and Rev-Response-Element RNA Complex via All Atom Molecular Dynamics Simulations

    Article • February 2018, MDPI AG

    Prof. Zaheer Ul-Haq

  24. Eriodictyol stimulates insulin secretion through cAMP/PKA signaling pathway in mice islets

    Article • European Journal of Pharmacology, February 2018, Elsevier

    Prof. Zaheer Ul-Haq

  25. 5-Acetyl-6-methyl-4-aryl-3,4-dihydropyrimidin-2(1 H )-ones: As potent urease inhibitors; synthesis, in vitro screening, and molecular modeling study

    Article • Bioorganic Chemistry, February 2018, Elsevier

    Prof. Zaheer Ul-Haq

  26. Pharmacologically Safe Nanomicelles of Amphotericin B With Lipids: Nuclear Magnetic Resonance and Molecular Docking Approach

    Article • Journal of Pharmaceutical Sciences, December 2017, Elsevier

    Prof. Zaheer Ul-Haq

  27. Synthesis of thiobarbituric acid derivatives: In vitro α -glucosidase inhibition and molecular docking studies

    Article • Bioorganic Chemistry, December 2017, Elsevier

    Prof. Zaheer Ul-Haq

  28. Atom and receptor based 3D QSAR models for generating new conformations from pyrazolopyrimidine as IL-2 inducible tyrosine kinase inhibitors

    Article • Journal of Molecular Graphics and Modelling, June 2017, Elsevier

    Dr. Majdi M. Bkhaitan, Prof. Zaheer Ul-Haq

  29. Reprofiling of full-length phosphonated carbocyclic 2′-oxa-3′-aza-nucleosides toward antiproliferative agents: Synthesis, antiproliferative activity, and molecular docking study

    Article • Chemical Biology & Drug Design, May 2017, Wiley

    Dr Anna Piperno, Dr Agha Zeeshan Mirza, Dr. Majdi M. Bkhaitan, Prof. Zaheer Ul-Haq

  30. Synthesis, molecular structure, spectral analysis, and biological activity of new malonamide derivatives as α-glucosidase inhibitors

    Article • Journal of Molecular Structure, April 2017, Elsevier

    Prof. Zaheer Ul-Haq

  31. Frontiers in Computational Chemistry

    Article • February 2017, Bentham Science Publishers

    Prof. Zaheer Ul-Haq

  32. Superoxide scavenging and antiglycation activity of rhinacanthins-rich extract obtained from the leaves of Rhinacanthus nasutus

    Article • Pharmacognosy Magazine, January 2017, Medknow

    Prof. Zaheer Ul-Haq

  33. Interleukin-4 receptor signaling and its binding mechanism: A therapeutic insight from inhibitors tool box

    Article • Cytokine & Growth Factor Reviews, December 2016, Elsevier

    Prof. Zaheer Ul-Haq

  34. Synthesis of pyrimidine-2,4,6-trione derivatives: Anti-oxidant, anti-cancer, α-glucosidase, β-glucuronidase inhibition and their molecular docking studies

    Article • Bioorganic Chemistry, October 2016, Elsevier

    Prof. Zaheer Ul-Haq

  35. Active site characterization and structure based 3D-QSAR studies on non-redox type 5-lipoxygenase inhibitors

    Article • European Journal of Pharmaceutical Sciences, June 2016, Elsevier

    Prof. Zaheer Ul-Haq

  36. 3D-QSAR Studies on Barbituric Acid Derivatives as Urease Inhibitors and the Effect of Charges on the Quality of a Model

    Article • International Journal of Molecular Sciences, April 2016, MDPI AG

    Prof. Zaheer Ul-Haq

  37. The immunomodulation potential of the synthetic derivatives of benzothiazoles: Implications in immune system disorders through in vitro and in silico studies

    Article • Bioorganic Chemistry, February 2016, Elsevier

    Prof. Zaheer Ul-Haq

  38. In silico based investigation of dynamic variations in neprilysin (NEP and NEP2) proteins for extracting the point of specificity

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

    Prof. Zaheer Ul-Haq

  39. Synthesis and dynamics studies of barbituric acid derivatives as urease inhibitors

    Article • Chemistry Central Journal, November 2015, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  40. Binding site identification and role of permanent water molecule of PIM-3 kinase: A molecular dynamics study

    Article • Journal of Molecular Graphics and Modelling, November 2015, Elsevier

    Prof. Zaheer Ul-Haq

  41. Structure based 3D-QSAR studies of Interleukin-2 inhibitors: Comparing the quality and predictivity of 3D-QSAR models obtained from different alignment methods and charge calculations

    Article • Chemico-Biological Interactions, August 2015, Elsevier

    Prof. Zaheer Ul-Haq

  42. In-silico identification of the binding mode of synthesized adamantyl derivatives inside cholinesterase enzymes

    Article • Acta Pharmacologica Sinica, May 2015, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  43. Gd-Complexes of New Arylpiperazinyl Conjugates of DTPA-Bis(amides): Synthesis, Characterization and Magnetic Relaxation Properties

    Article • Molecules, April 2015, MDPI AG

    Prof. Zaheer Ul-Haq

  44. 3D Structure Prediction of Human β1-Adrenergic Receptor via Threading-Based Homology Modeling for Implications in Structure-Based Drug Designing

    Article • PLOS One, April 2015, PLOS

    Prof. Zaheer Ul-Haq, Miss Maria Saeed

  45. Design and synthesis of chalcone derivatives as potent tyrosinase inhibitors and their structural activity relationship

    Article • Journal of Molecular Structure, April 2015, Elsevier

    Prof. Zaheer Ul-Haq, Assoc. Prof. Dr. Syed Adnan Ali Shah

  46. Frontiers in Computational Chemistry

    Article • February 2015, Bentham Science Publishers

    Prof. Zaheer Ul-Haq

  47. Synthesis, Bioactivity, Molecular Docking and POM Analyses of Novel Substituted Thieno[2,3-b]thiophenes and Related Congeners

    Article • Molecules, January 2015, MDPI AG

    Dr Assem Barakat, Prof. Zaheer Ul-Haq, Mohammad S. Mubarak

  48. Human serum albumin-specific recognition of the natural herbal extract of Stryphnodendron polyphyllum through STD NMR, hyphenations and docking simulation studies

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

    Prof. Zaheer Ul-Haq

  49. Evaluation of binding competition and group epitopes of acetylcholinesterase inhibitors by STD NMR, Tr-NOESY, DOSY and molecular docking: an old approach but new findings

    Article • MedChemComm, January 2015, Royal Society of Chemistry

    Prof. Zaheer Ul-Haq

  50. CoMFA and CoMSIA studies on a series of fluroquinolone derivatives for potential anti-inflammatory activity

    Article • Analytical Methods, July 2014, Royal Society of Chemistry

    Prof. Zaheer Ul-Haq

  51. Synthesis, Anti-microbial and Molecular Docking Studies of Quinazolin-4(3H)-one Derivatives

    Article • Molecules, June 2014, MDPI AG

    Dr Assem Barakat, Prof. Zaheer Ul-Haq

  52. Design of New and Potent Diethyl Thiobarbiturates as Urease Inhibitors: A Computational Approach

    Article • Bioinformation, May 2014, Biomedical Informatics

    Prof. Zaheer Ul-Haq

  53. Structure-based design, synthesis and biological evaluation of β-glucuronidase inhibitors

    Article • Journal of Computer-Aided Molecular Design, April 2014, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  54. Structure-based 3D-QSAR studies on quinazoline derivatives as platelets-derived growth factor (PDGFR) inhibitors

    Article • Medicinal Chemistry Research, March 2014, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  55. In Silico Identification and Evaluation of Leads for the Simultaneous Inhibition of Protease and Helicase Activities of HCV NS3/4A Protease Using Complex Based Pharmacophore Mapping and Virtual Screening

    Article • PLOS One, February 2014, PLOS

    Prof. Zaheer Ul-Haq

  56. First ComprehensiveIn SilicoAnalysis of the Functional and Structural Consequences of SNPs in HumanGalNAc-T1Gene

    Article • Computational and Mathematical Methods in Medicine, January 2014, Hindawi Publishing Corporation

    Dr Muhammad R. Manwar, Prof. Zaheer Ul-Haq

  57. Structural Basis of Binding and Rationale for the Potent Urease Inhibitory Activity of Biscoumarins

    Article • BioMed Research International, January 2014, Hindawi Publishing Corporation

    Prof. Zaheer Ul-Haq

  58. The exploration of interaction studies of smaller size, mostly ignored yet intrinsically inestimable molecules towards BSA; An example of STD and DOSY NMR

    Article • Central European Journal of Chemistry, December 2013, De Gruyter

    Prof. Zaheer Ul-Haq

  59. Molecular docking- and genetic algorithm-based approaches to produce robust 3D-QSAR models

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

    Prof. Zaheer Ul-Haq, Miss Maria Saeed

  60. Bioisosteric approach in designing new monastrol derivatives: An investigation on their ADMET prediction using in silico derived parameters

    Article • Journal of Molecular Graphics and Modelling, September 2013, Elsevier

    Prof. Zaheer Ul-Haq

  61. Brine shrimp lethality assay ‘an effective prescreen’: Microwave-assisted synthesis, BSL toxicity and 3DQSAR studies-based designing, docking and antitumor evaluation of potent chalcones

    Article • Pharmaceutical Biology, June 2013, Taylor & Francis

    Prof. Zaheer Ul-Haq

  62. Structure based virtual screening-driven identification of monastrol as a potent urease inhibitor

    Article • Journal of Molecular Graphics and Modelling, June 2013, Elsevier

    Prof. Zaheer Ul-Haq

  63. In-Silico Analysis of Chromone Containing Sulfonamide Derivatives as Human Carbonic Anhydrase Inhibitors

    Article • Medicinal Chemistry, April 2013, Bentham Science Publishers

    Prof. Zaheer Ul-Haq

  64. Identification of novel Interleukin-2 inhibitors through computational approaches

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

    Prof. Zaheer Ul-Haq

  65. In vitro and in silico exploration of IL-2 inhibition by small drug-like molecules

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

    Prof. Zaheer Ul-Haq

  66. Crude to leads: a triple-pronged direct NMR approach in coordination with docking simulation

    Article • The Analyst, January 2013, Royal Society of Chemistry

    Prof. Zaheer Ul-Haq

  67. A combined 3D-QSAR and docking studies for the In-silico prediction of HIV-protease inhibitors

    Article • Chemistry Central Journal, January 2013, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  68. In-vitro immunomodulatory and anti-cancerous activities of biotransformed products of Dianabol through Azadirachta indica and its molecular docking studies

    Article • Chemistry Central Journal, January 2013, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  69. Molecular docking simulation studies on potent butyrylcholinesterase inhibitors obtained from microbial transformation of dihydrotestosterone

    Article • Chemistry Central Journal, January 2013, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  70. Development of robust QSAR model using rapid overlay of crystal structures (ROCS) based alignment: a test case of Tubulin inhibitors

    Article • Medicinal Chemistry Research, November 2012, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  71. A combined 3D-QSAR and molecular docking strategy to understand the binding mechanism of V600EB-RAF inhibitors

    Article • Molecular Diversity, October 2012, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  72. Erratum to: Three-dimensional quantitative structure–activity relationship (CoMSIA) analysis of bis-coumerine analogues as urease inhibitors

    Article • Medicinal Chemistry Research, June 2012, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  73. Combined Pharmacophore and 3D-QSAR Study on A Series of Staphylococcus aureus Sortase A inhibitors

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

    Prof. Zaheer Ul-Haq

  74. Structure-based 3D-QSAR models and dynamics analysis of novel N-benzyl pyridinone as p38α MAP kinase inhibitors for anticytokine activity

    Article • Journal of Molecular Graphics and Modelling, June 2012, Elsevier

    Prof. Zaheer Ul-Haq

  75. Synthesis, biological evaluation, and molecular docking studies of benzyl, alkyl and glycosyl [2-(arylamino)-4,4-dimethyl-6-oxo-cyclohex-1-ene]carbodithioates, as potential immunomodulatory and immunosuppressive agents

    Article • Bioorganic & Medicinal Chemistry, May 2012, Elsevier

    Prof. Zaheer Ul-Haq

  76. Three-dimensional quantitative structure–activity relationship (CoMSIA) analysis of bis-coumerine analogues as urease inhibitors

    Article • Medicinal Chemistry Research, April 2012, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  77. A Novel Pharmacophore Model to Identify Leads for Simultaneous Inhibition of Anti-coagulation and Anti-inflammatory Activities of Snake Venom Phospholipase A2

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

    Prof. Zaheer Ul-Haq

  78. In Silico and In Vitro Immunomodulatory Studies on Compounds of Lindelofia stylosa

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

    Prof. Zaheer Ul-Haq

  79. Dynamic changes in the secondary structure of ECE-1 and XCE account for their different substrate specificities

    Article • BMC Bioinformatics, January 2012, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  80. 3D-QSPR Method of Computational Technique Applied on Red Reactive Dyes by Using CoMFA Strategy

    Article • International Journal of Molecular Sciences, December 2011, MDPI AG

    Prof. Zaheer Ul-Haq

  81. Molecular modeling-based antioxidant arylidene barbiturates as urease inhibitors

    Article • Journal of Molecular Graphics and Modelling, September 2011, Elsevier

    Prof. Zaheer Ul-Haq

  82. In silico studies on 2,3-dihydro-1,5-benzothiazepines as cholinesterase inhibitors

    Article • Medicinal Chemistry Research, August 2011, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  83. Optimization of Structure Based Virtual Screening Protocols Against Thymidine Monophosphate Kinase Inhibitors as Antitubercular Agents

    Article • Molecular Informatics, August 2011, Wiley

    Prof. Zaheer Ul-Haq

  84. Synthesis and QSAR analysis of chalcone derivatives as nitric oxide inhibitory agent

    Article • Medicinal Chemistry Research, July 2011, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  85. Synthesis of novel inhibitors of β-glucuronidase based on benzothiazole skeleton and study of their binding affinity by molecular docking

    Article • Bioorganic & Medicinal Chemistry, July 2011, Elsevier

    Prof. Zaheer Ul-Haq

  86. Molecular docking studies of potent inhibitors of tyrosinase and α-glucosidase

    Article • Medicinal Chemistry Research, June 2011, Springer Science + Business Media

    Prof. Zaheer Ul-Haq, Assoc. Prof. Dr. Syed Adnan Ali Shah

  87. Molecular dynamics simulation of mammalian 15S-lipoxygenase with AMBER force field

    Article • European Biophysics Journal, March 2011, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  88. Ligand-Based 3D-QSAR Studies of Diaryl Acyl-sulfonamide Analogues as Human Umbilical Vein Endothelial Cells Inhibitors Stimulated by VEGF

    Article • Chemical Biology & Drug Design, February 2011, Wiley

    Prof. Zaheer Ul-Haq

  89. Molecular and structural determinants of adamantyl susceptibility to HLA-DRs allelic variants: an in silico approach to understand the mechanism of MLEs

    Article • Journal of Computer-Aided Molecular Design, November 2010, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  90. Synthesis, antioxidant activities and urease inhibition of some new 1,2,4-triazole and 1,3,4-thiadiazole derivatives

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

    Prof. Zaheer Ul-Haq

  91. Docking and 3D-QSAR modeling of cyclin-dependent kinase 5/p25 inhibitors

    Article • Journal of Molecular Modeling, August 2010, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  92. Identification of Novel Urease Inhibitors by High-Throughput Virtual and in Vitro Screening

    Article • ACS Medicinal Chemistry Letters, July 2010, American Chemical Society (ACS)

    Prof. Zaheer Ul-Haq

  93. Benchmarking docking and scoring protocol for the identification of potential acetylcholinesterase inhibitors

    Article • Journal of Molecular Graphics and Modelling, June 2010, Elsevier

    Prof. Zaheer Ul-Haq

  94. Identification of potent urease inhibitors via ligand- and structure-based virtual screening and in vitro assays

    Article • Journal of Molecular Graphics and Modelling, June 2010, Elsevier

    Prof. Zaheer Ul-Haq

  95. Synthesis and biological activity of oxadiazole and triazolothiadiazole derivatives as tyrosinase inhibitors

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

    Prof. Zaheer Ul-Haq

  96. Classical and QM/MM MD simulations of sodium(I) and potassium(I) ions in aqueous solution

    Article • Journal of Molecular Liquids, May 2010, Elsevier

    Prof. Zaheer Ul-Haq

  97. Immunosuppressive Activity of Buxidin andE-Buxenone fromBuxus hyrcana

    Article • Chemical Biology & Drug Design, March 2010, Wiley

    Prof. Zaheer Ul-Haq

  98. In silico modeling of the specific inhibitory potential of thiophene-2,3-dihydro-1,5-benzothiazepine against BChE in the formation of β-amyloid plaques associated with Alzheimer's disease

    Article • Theoretical Biology and Medical Modelling, January 2010, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  99. Template-based structure prediction and molecular dynamics simulation study of two mammalian Aspartyl-tRNA synthetases

    Article • Journal of Molecular Graphics and Modelling, January 2010, Elsevier

    Prof. Zaheer Ul-Haq

  100. Ligand-based 3D-QSAR Studies of Physostigmine Analogues as Acetylcholinesterase Inhibitors

    Article • Chemical Biology & Drug Design, December 2009, Wiley

    Prof. Zaheer Ul-Haq

  101. Molecular dynamics simulation of Axillaridine–A: A potent natural cholinesterase inhibitor

    Article • Journal of Enzyme Inhibition and Medicinal Chemistry, April 2009, Taylor & Francis

    Prof. Zaheer Ul-Haq

  102. Prediction of Binding Affinities for Hydroxamic Acid Derivatives as Urease Inhibitors by Molecular Docking and 3D-QSAR Studies

    Article • Letters in Drug Design & Discovery, March 2009, Bentham Science Publishers

    Prof. Zaheer Ul-Haq

  103. An investigation of the kinetic and anti-angiogenic properties of plant glycoside inhibitors of thymidine phosphorylase

    Article • Journal of Asian Natural Products Research, February 2009, Taylor & Francis

    Prof. Zaheer Ul-Haq

  104. Receptor-Based 3D-QSAR Study for Recognizing True Binding Mode of Mercaptoacyldipeptides at the Active Site of Neutral Endopeptidase

    Article • Medicinal Chemistry, January 2009, Bentham Science Publishers

    Prof. Zaheer Ul-Haq

  105. CoMFA and CoMSIA 3D-QSAR analysis on hydroxamic acid derivatives as urease inhibitors

    Article • Journal of Enzyme Inhibition and Medicinal Chemistry, October 2008, Taylor & Francis

    Prof. Zaheer Ul-Haq

  106. In silicostudies of urease inhibitors to explore ligand-enzyme interactions

    Article • Journal of Enzyme Inhibition and Medicinal Chemistry, October 2008, Taylor & Francis

    Prof. Zaheer Ul-Haq

  107. Receptor-Based Modeling and 3D-QSAR for a Quantitative Production of the Butyrylcholinesterase Inhibitors Based on Genetic Algorithm

    Article • Journal of Chemical Information and Modeling, May 2008, American Chemical Society (ACS)

    Prof. Zaheer Ul-Haq

  108. 3D-QSAR CoMFA studies on bis-coumarine analogues as urease inhibitors: A strategic design in anti-urease agents

    Article • Bioorganic & Medicinal Chemistry, March 2008, Elsevier

    Prof. Zaheer Ul-Haq

  109. Family 18 chitolectins: Comparison of MGP40 and HUMGP39

    Article • Biochemical and Biophysical Research Communications, July 2007, Elsevier

    Prof. Zaheer Ul-Haq

  110. Successful computer guided planned synthesis of (4R)-thiazolidine carboxylic acid and its 2-substituted analogues as urease inhibitors

    Article • Molecular Diversity, May 2006, Springer Science + Business Media

    Prof. Zaheer Ul-Haq

  111. Biological and molecular docking studies on coagulin-H: Human IL-2 novel natural inhibitor

    Article • Molecular Immunology, April 2006, Elsevier

    Prof. Zaheer Ul-Haq

  112. Withanolides, a new class of natural cholinesterase inhibitors with calcium antagonistic properties

    Article • Biochemical and Biophysical Research Communications, August 2005, Elsevier

    Prof. Zaheer Ul-Haq

  113. Juliflorine: A potent natural peripheral anionic-site-binding inhibitor of acetylcholinesterase with calcium-channel blocking potential, a leading candidate for Alzheimer’s disease therapy

    Article • Biochemical and Biophysical Research Communications, July 2005, Elsevier

    Prof. Zaheer Ul-Haq

  114. Presence of Antispasmodic, Antidiarrheal, Antisecretory, Calcium Antagonist and Acetylcholinesterase Inhibitory Steroidal Alkaloids inSarcococca saligna

    Article • Planta Medica, February 2005, Thieme Publishing Group

    Prof. Zaheer Ul-Haq

  115. Cholinesterase inhibitory and spasmolytic potential of steroidal alkaloids

    Article • The Journal of Steroid Biochemistry and Molecular Biology, December 2004, Elsevier

    Prof. Zaheer Ul-Haq

  116. New pregnane-type steroidal alkaloids from Sarcococca saligna and their cholinesterase inhibitory activity

    Article • Steroids, October 2004, Elsevier

    Prof. Zaheer Ul-Haq

  117. Kinetics and structure–activity relationship studies on pregnane-type steroidal alkaloids that inhibit cholinesterases

    Article • Bioorganic & Medicinal Chemistry, May 2004, Elsevier

    Prof. Zaheer Ul-Haq

  118. New Cholinesterase-Inhibiting Steroidal Alkaloids fromSarcococca saligna

    Article • Helvetica Chimica Acta, February 2004, Wiley

    Prof. Zaheer Ul-Haq

  119. 3D-QSAR Studies on natural acetylcholinesterase inhibitors of Sarcococca saligna by comparative molecular field analysis (CoMFA)

    Article • Bioorganic & Medicinal Chemistry Letters, December 2003, Elsevier

    Prof. Zaheer Ul-Haq

  120. Molecular Docking Studies of Natural Cholinesterase-Inhibiting Steroidal Alkaloids fromSarcococcasaligna

    Article • Journal of Medicinal Chemistry, November 2003, American Chemical Society (ACS)

    Prof. Zaheer Ul-Haq

  121. New Steroidal Alkaloids FromSarcococca Saligna

    Article • Natural Product Research, August 2003, Taylor & Francis

    Prof. Zaheer Ul-Haq

  122. Pregnane-Type Steroidal Alkaloids ofSarcococca saligna: a New Class of Cholinesterase Inhibitors

    Article • Helvetica Chimica Acta, February 2002, Wiley

    Prof. Zaheer Ul-Haq