All Stories

  1. Synthesis, Molecular Docking, and Cytotoxic Evaluation of Fluorinated Podophyllotoxin Derivatives

    Article • Natural Product Communications, February 2023, SAGE Publications

    Assoc. Prof. Dr Hai Pham-The

  2. Chemical Profile and Biological Activities of Fungal Strains Isolated from Piper nigrum Roots: Experimental and Computational Approaches

    Article • Chemistry & Biodiversity, January 2023, Wiley

    Assoc. Prof. Dr Hai Pham-The

  3. A Review of Computational Approaches Targeting SARS-CoV-2 Main Protease to the Discovery of New Potential Antiviral Compounds

    Article • Current Topics in Medicinal Chemistry, January 2023, Bentham Science Publishers

    Assoc. Prof. Dr Hai Pham-The, Juan Castillo-Garit, Dr Huong Le-Thi-Thu, Facundo Perez-Gimenez

  4. Design, Synthesis and Evaluation of Novel (E)-N'-((1-(4-chlorobenzyl)-1H-indol-3-yl)methylene)-2-(4-oxoquinazolin-3(4H)-yl)acetohydrazides as Antitumor Agents

    Article • Anti-Cancer Agents in Medicinal Chemistry, August 2022, Bentham Science Publishers

    Assoc. Prof. Dr Hai Pham-The

  5. Machine Learning Applications in Nanomedicine and Nanotoxicology

    Article • May 2022, IGI Global

    Assoc. Prof. Dr Hai Pham-The

  6. Ligand-based discovery of new potential acetylcholinesterase inhibitors for Alzheimer’s disease treatment

    Article • SAR and QSAR in Environmental Research, January 2022, Taylor & Francis

    Assoc. Prof. Dr Hai Pham-The

  7. In silico screening of drug inhibitors of SARS-CoV-2RNA-dependent RNA polymerase target

    Article • Ministry of Science and Technology Vietnam, December 2021, Vietnam Journal of Science Technology and Engineering

    Assoc. Prof. Dr Hai Pham-The

  8. <em>QSARINS Based </em>Computational Identification of Sars-Cov-2 Main Protease Inhibitors

    Article • November 2021, MDPI AG

    Assoc. Prof. Dr Hai Pham-The

  9. Essential oils of Uvaria boniana – chemical composition, in vitro bioactivity, docking, and in silico ADMET profiling of selective major compounds

    Article • Zeitschrift für Naturforschung C, November 2021, De Gruyter

    Assoc. Prof. Dr Hai Pham-The

  10. Design, synthesis, and evaluation of novel (E)‐ N '‐(3‐allyl‐2‐hydroxy)benzylidene‐2‐(4‐oxoquinazolin‐3(4 H )‐yl)acetohydrazides as antitumor agents

    Article • Archiv der Pharmazie, October 2021, Wiley

    Assoc. Prof. Dr Hai Pham-The

  11. Novel Conjugated Quinazolinone-Based Hydroxamic Acids: Design, Synthesis and Biological Evaluation

    Article • Medicinal Chemistry, August 2021, Bentham Science Publishers

    Assoc. Prof. Dr Hai Pham-The, Prof Tran Khac Vu, Anh Lai

  12. Evaluating Protein Tyrosine Phosphatase 1B Inhibitory Activity of Bioactive Compounds from Momordica charantia for Diabetes Treatment Type 2 by using Molecular Docking Method

    Article • VNU Journal of Science Medical and Pharmaceutical Sciences, June 2021, Vietnam National University Journal of Science

    Assoc. Prof. Dr Hai Pham-The

  13. Novel 4-Oxoquinazoline-Based N-Hydroxypropenamides as Histone Deacetylase Inhibitors: Design, Synthesis, and Biological Evaluation

    Article • ACS Omega, February 2021, American Chemical Society (ACS)

    Assoc. Prof. Dr Hai Pham-The

  14. Computational identification of chemical compounds with potential anti-Chagas activity using a classification tree

    Article • SAR and QSAR in Environmental Research, January 2021, Taylor & Francis

    Assoc. Prof. Dr Hai Pham-The

  15. Screening Virtual ACE2 Enzyme Inhibitory Activity of Compounds for COVID-19 Treatment Based on Molecular Docking

    Article • VNU Journal of Science Medical and Pharmaceutical Sciences, December 2020, Vietnam National University Journal of Science

    Assoc. Prof. Dr Hai Pham-The

  16. Design, synthesis and evaluation of novel indirubin-based N-hydroxybenzamides, N-hydroxypropenamides and N-hydroxyheptanamides as histone deacetylase inhibitors and antitumor agents

    Article • Bioorganic & Medicinal Chemistry Letters, November 2020, Elsevier

    Assoc. Prof. Dr Hai Pham-The

  17. Synthesis and biological evaluation of novel quinazoline-triazole hybrid compounds with potential use in Alzheimer’s disease

    Article • Bioorganic & Medicinal Chemistry Letters, September 2020, Elsevier

    Assoc. Prof. Dr Hai Pham-The

  18. Exploration of certain 1,3-oxazole- and 1,3-thiazole-based hydroxamic acids as histone deacetylase inhibitors and antitumor agents

    Article • Bioorganic Chemistry, August 2020, Elsevier

    Assoc. Prof. Dr Hai Pham-The

  19. Design, Synthesis and Bioevaluation of Two Series of 3‐[(1‐Benzyl‐1 H ‐1,2,3‐triazol‐4‐yl)methyl]quinazolin‐4(3 H )‐ones and N ‐(1‐Benzylpiperidin‐4‐yl)quinazolin‐4‐amines

    Article • Chemistry & Biodiversity, June 2020, Wiley

    Assoc. Prof. Dr Hai Pham-The

  20. Emerging Role of Circulating Tumor Cells in Gastric Cancer

    Article • Cancers, March 2020, MDPI AG

    Assoc. Prof. Dr Hai Pham-The

  21. New Acetohydrazides Incorporating 2‐Oxoindoline and 4‐Oxoquinazoline: Synthesis and Evaluation of Cytotoxicity and Caspase Activation Activity

    Article • Chemistry & Biodiversity, March 2020, Wiley

    Assoc. Prof. Dr Hai Pham-The

  22. Design, synthesis, and evaluation of novel N'-substituted-1-(4-chlorobenzyl)-1H-indol-3-carbohydrazides as antitumor agents

    Article • Journal of Enzyme Inhibition and Medicinal Chemistry, January 2020, Taylor & Francis

    Assoc. Prof. Dr Hai Pham-The

  23. Design, synthesis, and bioevaluation of novel oxoindolin-2-one derivatives incorporating 1-benzyl-1H-1,2,3-triazole

    Article • Medicinal Chemistry Research, December 2019, Springer Science + Business Media

    Assoc. Prof. Dr Hai Pham-The

  24. Design, Synthesis and Biological Evaluation of Novel N-hydroxyheptanamides Incorporating 6-hydroxy-2-methylquinazolin-4(3H)-ones as Histone Deacetylase Inhibitors and Cytotoxic Agents

    Article • Anti-Cancer Agents in Medicinal Chemistry, December 2019, Bentham Science Publishers

    Assoc. Prof. Dr Hai Pham-The

  25. Novel 3,4-dihydro-4-oxoquinazoline-based acetohydrazides: Design, synthesis and evaluation of antitumor cytotoxicity and caspase activation activity

    Article • Bioorganic Chemistry, November 2019, Elsevier

    Assoc. Prof. Dr Hai Pham-The

  26. Higher-Order and Mixed Discrete Derivatives such as a Novel Graph- Theoretical Invariant for Generating New Molecular Descriptors

    Article • Current Topics in Medicinal Chemistry, July 2019, Bentham Science Publishers

    Dr Huong Le-Thi-Thu, Ricardo Vivas-Reyes, Assoc. Prof. Dr Hai Pham-The

  27. Beyond model interpretability using LDA and decision trees for α‐amylase and α‐glucosidase inhibitor classification studies

    Article • Chemical Biology & Drug Design, May 2019, Wiley

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Karel Dieguez Santana

  28. Quinazolin‐4(3 H )‐one‐Based Hydroxamic Acids: Design, Synthesis and Evaluation of Histone Deacetylase Inhibitory Effects and Cytotoxicity

    Article • Chemistry & Biodiversity, March 2019, Wiley

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  29. Computational Identification of Chemical Compounds with Potential Activity against Leishmania amazonensis using Nonlinear Machine Learning Techniques

    Article • Current Topics in Medicinal Chemistry, January 2019, Bentham Science Publishers

    Assoc. Prof. Dr Hai Pham-The, Juan Castillo-Garit, Facundo Perez-Gimenez, Dr Huong Le-Thi-Thu

  30. In Silico Assessment of ADME Properties: Advances in Caco-2 Cell Monolayer Permeability Modeling

    Article • Current Topics in Medicinal Chemistry, January 2019, Bentham Science Publishers

    Assoc. Prof. Dr Hai Pham-The, Dr Huong Le-Thi-Thu, Dr Miguel Ángel Cabrera-Pérez, Nguyen Hai Nam, Juan Castillo-Garit

  31. (E)-N'-Arylidene-2-(4-oxoquinazolin-4(3H)-yl) acetohydrazides: Synthesis and evaluation of antitumor cytotoxicity and caspase activation activity

    Article • Journal of Enzyme Inhibition and Medicinal Chemistry, January 2019, Taylor & Francis

    Assoc. Prof. Dr Hai Pham-The, Dr Huong Le-Thi-Thu

  32. Radicular cyst in a primary molar following pulp therapy with gutta percha: A case report and literature review

    Article • Journal of Clinical and Experimental Dentistry, January 2019, Medicina Oral, S.L.

    Assoc. Prof. Dr Hai Pham-The

  33. Machine Learning Applications in Nanomedicine and Nanotoxicology

    Article • International Journal of Applied Nanotechnology Research, January 2019, IGI Global

    Assoc. Prof. Dr Hai Pham-The

  34. Design, synthesis and evaluation of novel hybrids between 4-anilinoquinazolines and substituted triazoles as potent cytotoxic agents

    Article • Bioorganic & Medicinal Chemistry Letters, December 2018, Elsevier

    Assoc. Prof. Dr Hai Pham-The

  35. Design, Synthesis and Evaluation of Novel 3/4-((Substituted benzamidophenoxy)methyl)-N-hydroxybenzamides / propenamides as Histone Deacetylase Inhibitors and Antitumor Agents

    Article • Anti-Cancer Agents in Medicinal Chemistry, November 2018, Bentham Science Publishers

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  36. Novel Hydroxamic Acids Incorporating 1-((1H-1,2,3-Triazol-4-yl)methyl)- 3-substituted-2-oxoindolines: Synthesis, Biological Evaluation and SAR Analysis

    Article • Medicinal Chemistry, November 2018, Bentham Science Publishers

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Nguyen Hai Nam, Mai-Dung Do Thi

  37. N ′-[(E )-Arylidene]-2-(2,3-dihydro-3-oxo-4H -1,4-benzoxazin-4-yl)-acetohydrazides: Synthesis and Evaluation of Caspase Activation Activity and Cytotoxicity

    Article • Chemistry & Biodiversity, September 2018, Wiley

    Assoc. Prof. Dr Hai Pham-The, Nguyen Hai Nam

  38. Integrating theoretical and experimental permeability estimations for provisional biopharmaceutical classification: Application to the WHO essential medicines

    Article • Biopharmaceutics & Drug Disposition, July 2018, Wiley

    Dr Miguel Ángel Cabrera-Pérez, Assoc. Prof. Dr Hai Pham-The

  39. Quinazoline-Based Hydroxamic Acids: Design, Synthesis, and Evaluation of Histone Deacetylase Inhibitory Effects and Cytotoxicity

    Article • Chemistry & Biodiversity, June 2018, Wiley

    Assoc. Prof. Dr Hai Pham-The, Dr Huong Le-Thi-Thu, Tien-Anh Duong, Nguyen Hai Nam

  40. Novel hydroxamic acids incorporating 1-((1H-1,2,3-Triazol-4-yl)methyl)-3-hydroxyimino-indolin-2-ones: synthesis, biological evaluation, and SAR analysis

    Article • Journal of Chemical Sciences, June 2018, Springer Science + Business Media

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  41. Computational modeling of human oral bioavailability: what will be next?

    Article • Expert Opinion on Drug Discovery, April 2018, Taylor & Francis

    Assoc. Prof. Dr Hai Pham-The, Dr Miguel Ángel Cabrera-Pérez

  42. Learning from Multiple Classifier Systems: Perspectives for Improving Decision Making of QSAR Models in Medicinal Chemistry

    Article • Current Topics in Medicinal Chemistry, February 2018, Bentham Science Publishers

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Juan Castillo-Garit, Karel Dieguez Santana

  43. A desirability-based multi objective approach for the virtual screening discovery of broad-spectrum anti-gastric cancer agents

    Article • PLoS ONE, February 2018, PLOS

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Professor Fernanda Borges, M. Natalia D. S. Cordeiro

  44. Design, synthesis and evaluation of novel N -hydroxybenzamides/ N -hydroxypropenamides incorporating quinazolin-4(3 H )-ones as histone deacetylase inhibitors and antitumor agents

    Article • Bioorganic Chemistry, February 2018, Elsevier

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  45. INTEGRATING STRUCTURE AND LIGAND-BASED APPROACHES FOR MODELLING THE HISTONE DEACETYLASE INHIBITION ACTIVITY OF HYDROXAMIC ACID DERIVATIVES

    Article • Asian Journal of Pharmaceutical and Clinical Research, February 2018, Innovare Academic Sciences Pvt Ltd

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  46. Atom based linear index descriptors in QSAR-machine learning classifiers for the prediction of ubiquitin-proteasome pathway activity

    Article • Medicinal Chemistry Research, January 2018, Springer Science + Business Media

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  47. Blood-Brain Barrier Passage Prediction Using Decision Tree

    Article • October 2017, MDPI AG

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  48. Machine learning-based models to predict modes of toxic action of phenols to Tetrahymena pyriformis

    Article • SAR and QSAR in Environmental Research, September 2017, Taylor & Francis

    Assoc. Prof. Dr Hai Pham-The, Dr Huong Le-Thi-Thu

  49. A Two QSAR Way for Antidiabetic Agents Targeting Using α-Amylase and α-Glucosidase Inhibitors: Model Parameters Settings in Artificial Intelligence Techniques

    Article • Letters in Drug Design & Discovery, July 2017, Bentham Science Publishers

    Karel Dieguez Santana, Assoc. Prof. Dr Hai Pham-The

  50. QuBiLS-MAS, open source multi-platform software for atom- and bond-based topological (2D) and chiral (2.5D) algebraic molecular descriptors computations

    Article • Journal of Cheminformatics, June 2017, Springer Science + Business Media

    Assoc. Prof. Dr Hai Pham-The

  51. Exploration of some indole-based hydroxamic acids as histone deacetylase inhibitors and antitumor agents

    Article • Chemical Papers, April 2017, Springer Science + Business Media

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  52. Novel N -hydroxybenzamides incorporating 2-oxoindoline with unexpected potent histone deacetylase inhibitory effects and antitumor cytotoxicity

    Article • Bioorganic Chemistry, April 2017, Elsevier

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  53. Dry selection and wet evaluation for the rational discovery of new anthelmintics

    Article • Molecular Physics, March 2017, Taylor & Francis

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Juan Castillo-Garit

  54. Quantitative structure–activity relationship analysis and virtual screening studies for identifying HDAC2 inhibitors from known HDAC bioactive chemical libraries

    Article • SAR and QSAR in Environmental Research, February 2017, Taylor & Francis

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Karel Dieguez Santana

  55. A Simple Method to Predict Blood-Brain Barrier Permeability of Drug-Like Compounds Using Classification Trees

    Article • Medicinal Chemistry, February 2017, Bentham Science Publishers

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Juan Castillo-Garit

  56. Prediction of acute toxicity of phenol derivatives using multiple linear regression approach for Tetrahymena pyriformis contaminant identification in a median-size database

    Article • Chemosphere, December 2016, Elsevier

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Karel Dieguez Santana, Juan Castillo-Garit

  57. Exploring different strategies for imbalanced ADME data problem: case study on Caco-2 permeability modeling

    Article • Molecular Diversity, December 2015, Springer Science + Business Media

    Marival Bermejo Sanz, Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Dr Miguel Ángel Cabrera-Pérez

  58. Towards computational prediction of Biopharmaceutics Classification System: a QSPR approach

    Article • December 2015, MDPI AG

    Assoc. Prof. Dr Hai Pham-The, Dr Huong Le-Thi-Thu

  59. Multi-Criteria Decision Making: the Best Choice for the Modeling of Chemicals against Hyper-Pigmentation?

    Article • Current Bioinformatics, November 2015, Bentham Science Publishers

    Dr Bui Thanh Tung, Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The

  60. Novel 3-substituted-2-oxoindoline-based N-hydroxypropenamides as Histone Deacetylase Inhibitors and Antitumor Agents

    Article • Medicinal Chemistry, October 2015, Bentham Science Publishers

    Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Nguyen Hai Nam

  61. Provisional Classification andin SilicoStudy of Biopharmaceutical System Based on Caco-2 Cell Permeability and Dose Number

    Article • Molecular Pharmaceutics, June 2013, American Chemical Society (ACS)

    Marival Bermejo Sanz, Assoc. Prof. Dr Hai Pham-The, Dr Miguel Ángel Cabrera-Pérez

  62. The Use of Rule-Based and QSPR Approaches in ADME Profiling: A Case Study on Caco-2 Permeability

    Article • Molecular Informatics, May 2013, Wiley

    Marival Bermejo Sanz, Dr Huong Le-Thi-Thu, Assoc. Prof. Dr Hai Pham-The, Dr Miguel Ángel Cabrera-Pérez

  63. QSPR in Oral Bioavailability: Specificity or Integrality?

    Article • Mini-Reviews in Medicinal Chemistry, May 2012, Bentham Science Publishers

    Assoc. Prof. Dr Hai Pham-The

  64. In Silico Prediction of Caco-2 Cell Permeability by a Classification QSAR Approach

    Article • Molecular Informatics, March 2011, Wiley

    Marival Bermejo Sanz, Assoc. Prof. Dr Hai Pham-The, Dr Miguel Ángel Cabrera-Pérez

  65. Prioritizing Hits with Appropriate Trade-Offs Between HIV-1 Reverse Transcriptase Inhibitory Efficacy and MT4 Blood Cells Toxicity Through Desirability-Based Multiobjective Optimization and Ranking

    Article • Molecular Informatics, April 2010, Wiley

    Professor Fernanda Borges, Assoc. Prof. Dr Hai Pham-The, M. Natalia D. S. Cordeiro