Skip to content
GraphTheory.in

Suraj N. Mali

D.Y. Patil UniversityIN
ORCID0000-0003-1995-136X
Claim this profile
h-index
33

via OpenAlex

Citations
4,036

via OpenAlex

Publications
266

About

Email: mali.suraj1695@gmail.com ; surajmali1695@gmail.com [1] Suraj Mali formerly worked at Dr. Reddys Laboratories, Hyderabad as an Analytical Scientist and previously studied at the Department of Pharmaceutical Science and Technology, Institute of Chemical Technology, Mumbai. [2] He is a reviewer of the Journal of heterocyclic chemistry, Nature Scientific Reports, SAR and QSAR in Environmental Research, Chemical Biology & Drug Design, ACS Omega, and Medicinal Chemistry Research. He is currently selected as Bentham Science Brand Ambassador for the years 2019-2020. [3] He has 130+ Publications in International Journals with an H index of 28, i10:41, with 1551+ citations. [4] He has already been Awarded "Institute of Chemical Technology, ICT's Masters Best Thesis Aditya Birla Award-2019". [5] He has expertise in various areas of research such as molecular modeling, synthetic chemistry, Phytochemistry, Pharmacology, and analytics. The research interest ranges from projects dealing with computer-assisted drug design, QSAR, Biomolecular Simulations, Drug screening, Drug development, and Synthesis of compounds of medicinal value and related compounds (impurity standards) along with the structure elucidation and characterization. [6] He has recent publications in 'Nature Scientific Reports, titled, Identification of hydantoin based decaprenylphosphoryl-β-d-ribose oxidase (DprE1) inhibitors as antimycobacterial agents using computational tools'.

Research areas

  • Chemistry
  • Medicine
  • Biology
  • Organic chemistry
  • Biochemistry

Publications (266)

Sorted by most cited.

  1. Green Surfactants (Biosurfactants): A Petroleum-Free Substitute for Sustainability─Comparison, Applications, Market, and Future Prospects

    ACS Omega2023journal article

    View DOI
    342 cites

  2. Silver Nanoparticles (AgNPs): Comprehensive Insights into Bio/Synthesis, Key Influencing Factors, Multifaceted Applications, and Toxicity─A 2024 Update

    ACS Omega2025journal article

    View DOI
    303 cites

  3. Recent trends in the application of essential oils: The next generation of food preservation and food packaging

    Trends in Food Science & Technology2022journal article

    View DOI
    254 cites

  4. An Updated Review on the Multifaceted Therapeutic Potential of Calendula officinalis L.

    Pharmaceuticals2023journal article

    View DOI
    148 cites

  5. Design, synthesis, antimicrobial activity and computational studies of novel azo linked substituted benzimidazole, benzoxazole and benzothiazole derivatives

    Computational Biology and Chemistry1970journal article

    View DOI
    144 cites

  6. Mini-Review of the Importance of Hydrazides and Their Derivatives—Synthesis and Biological Activity

    Engineering Proceedings2021journal article

    View DOI
    78 cites

  7. Computational Studies on Imidazo[1,2-a] Pyridine-3-Carboxamide Analogues as Antimycobacterial Agents: Common Pharmacophore Generation, Atom-based 3D-QSAR, Molecular dynamics Simulation, QikProp, Molecular Docking and Prime MMGBSA Approaches

    Open Pharmaceutical Sciences Journal2018journal article

    View DOI
    68 cites

  8. Identification of hydantoin based Decaprenylphosphoryl-β-d-Ribose Oxidase (DprE1) inhibitors as antimycobacterial agents using computational tools

    Scientific Reports2022journal article

    View DOI
    56 cites

  9. Emerging Applications of Nanotechnology in Cosmeceutical Health Science: Latest Updates

    Health Sciences Review2022journal article

    View DOI
    53 cites

  10. Molecular Modeling Studies on 2,4-Disubstituted Imidazopyridines as Anti-Malarials: Atom-Based 3D-QSAR, Molecular Docking, Virtual Screening, In-Silico ADMET and Theoretical Analysis

    Journal of Computational Biophysics and Chemistry2021journal article

    View DOI
    51 cites

  11. The anti-SARS-CoV-2 activity of novel 9, 10-dihydrophenanthrene derivatives: an insight into molecular docking, ADMET analysis, and molecular dynamics simulation

    Scientific African2023journal article

    View DOI
    50 cites

  12. Cyclohexane-1,3-dione Derivatives as Future Therapeutic Agents for NSCLC: QSAR Modeling, In Silico ADME-Tox Properties, and Structure-Based Drug Designing Approach

    ACS Omega2023journal article

    View DOI
    49 cites

  13. Balanced QSAR and Molecular Modeling to Identify Structural Requirements of Imidazopyridine Analogues as Anti-infective Agents against Trypanosomiases

    Journal of Computational Biophysics and Chemistry1970journal article

    View DOI
    49 cites

  14. Multiple QSAR and molecular modelling for identification of potent human adenovirus inhibitors

    Journal of the Indian Chemical Society1970journal article

    View DOI
    49 cites

  15. Molecular modelling studies for 4-Oxo-1,4-Dihydroquinoline-3-Carboxamide Derivatives as Anticancer agents

    Medicine in Drug Discovery2019journal article

    View DOI
    48 cites

  16. Multiple 3D- and 2D-quantitative structure–activity relationship models (QSAR), theoretical study and molecular modeling to identify structural requirements of imidazopyridine analogues as anti-infective agents against tuberculosis

    Structural Chemistry2022journal article

    View DOI
    47 cites

  17. Synthesis, admetSAR Predictions, DPPH Radical Scavenging Activity, and Potent Anti-mycobacterial Studies of Hydrazones of Substituted 4-(anilino methyl) benzohydrazides (Part 2)

    Current Computer-Aided Drug Design2021journal article

    View DOI
    47 cites

  18. Synthesis, In silico and In vitro Analysis of Hydrazones as Potential Antituberculosis Agents

    Current Computer-Aided Drug Design2021journal article

    View DOI
    47 cites

  19. Synthesis and Evaluation of Anticancer Activity of Pyrazolone Appended Triarylmethanes (TRAMs)

    ChemistrySelect1970journal article

    View DOI
    47 cites

  20. Neem oil as natural pesticide: Pseudo ternary diagram and computational study

    Journal of the Indian Chemical Society1970journal article

    View DOI
    45 cites

  21. Synthesis, biological evaluation and molecular modelling of 3-Formyl-6-isopropylchromone derived thiosemicarbazones as α-glucosidase inhibitors

    Bioorganic Chemistry2023journal article

    View DOI
    42 cites

  22. Synthesis of New Hydrazones Using a Biodegradable Catalyst, Their Biological Evaluations and Molecular Modeling Studies (Part-II)

    Journal of Computational Biophysics and Chemistry2022journal article

    View DOI
    41 cites

  23. Synthesis, bioactivities, DFT and <i>in-silico</i> appraisal of azo clubbed benzothiazole derivatives

    Journal of Molecular Structure1970journal article

    View DOI
    41 cites

  24. Molecular modelling studies on adamantane-based Ebola virus GP-1 inhibitors using docking, pharmacophore and 3D-QSAR

    SAR and QSAR in Environmental Research1970journal article

    View DOI
    41 cites

  25. L-Proline: A Versatile Organo-Catalyst in Organic Chemistry

    Combinatorial Chemistry & High Throughput Screening2023journal article

    View DOI
    39 cites

  26. Synthesis, SAR, In silico Appraisal and Anti-Microbial Study of Substituted 2-aminobenzothiazoles Derivatives

    Current Computer-Aided Drug Design2021journal article

    View DOI
    39 cites

  27. Synthesis, in silico and biological studies of thiazolyl-2h-chromen-2-one derivatives as potent antitubercular agents

    Current Computer-Aided Drug Design1970journal article

    View DOI
    38 cites

  28. Chitosan hydrochloride mediated efficient, green catalysis for the synthesis of perimidine derivatives

    Journal of Heterocyclic Chemistry1970journal article

    View DOI
    38 cites

  29. From Past to Present: Gold Nanoparticles (AuNPs) in Daily Life─Synthesis Mechanisms, Influencing Factors, Characterization, Toxicity, and Emerging Applications in Biomedicine, Nanoelectronics, and Materials Science

    ACS Omega2025journal article

    View DOI
    37 cites

  30. Synthesis and anti-mycobacterium study on halo-substituted 2-aryl oxyacetohydrazones

    Current Computer-Aided Drug Design1970journal article

    View DOI
    36 cites

  31. Neuroprotective potential of cannabidiol: Molecular mechanisms and clinical implications

    Journal of Integrative Medicine2023journal article

    View DOI
    35 cites

  32. Synthesis, Antimicrobial Screening and In Silico Appraisal of Iminocarbazole Derivatives

    ChemistrySelect1970journal article

    View DOI
    34 cites

  33. Synthesis, spectroscopic, in-vitro and computational analysis of hydrazones as potential antituberculosis agents: (part-I)

    Combinatorial Chemistry and High Throughput Screening1970journal article

    View DOI
    33 cites

  34. In Silico Appraisal, Synthesis, Antibacterial Screening and DNA Cleavage for 1,2,5-thiadiazole Derivative

    Current Computer-Aided Drug Design1970journal article

    View DOI
    32 cites

  35. Silver Nanoparticles (AgNPs) as Potential Antiviral Agents: Synthesis, Biophysical Properties, Safety, Challenges and Future Directions─Update Review

    Molecules2025journal article

    View DOI
    31 cites

  36. Development of curcumin integrated smart pH indicator, antibacterial, and antioxidant waste derived Artocarpus lakoocha starch-based packaging film

    International Journal of Biological Macromolecules2024journal article

    View DOI
    31 cites

  37. Brønsted Acid Catalyzed Domino Synthesis of Functionalized 4H-Chromens and Their ADMET, Molecular Docking and Antibacterial Studies

    ChemistrySelect1970journal article

    View DOI
    30 cites

  38. New 2-Chloroimidazo[1,2-a]pyridine induced Schiff bases: synthesis, characterization, antimicrobial and A-498 and A-549 anticancer activity, molecular modeling, in-silico pharmacokinetics, and DFT studies

    Chemical Physics Impact2024journal article

    View DOI
    27 cites

  39. Molecular Modeling Approaches to Investigate Essential Oils (Volatile Compounds) Interacting with Molecular Targets

    Essential Oils1970book chapter

    View DOI
    27 cites

  40. Novel 2-substituted-quinoxaline analogs with potential antiproliferative activity against breast cancer: insights into cell cycle arrest, topoisomerase II, and EGFR activity

    RSC Advances1970journal article

    View DOI
    25 cites

  41. From lab to nature: Recent advancements in the journey of gastroprotective agents from medicinal chemistry to phytotherapy

    European Journal of Medicinal Chemistry2024journal article

    View DOI
    24 cites

  42. Repositioning Cannabinoids and Terpenes as Novel EGFR-TKIs Candidates for Targeted Therapy Against Cancer: A virtual screening model using CADD and biophysical simulations

    Heliyon2023journal article

    View DOI
    23 cites

  43. Synthesis, In-Silico Potential Enzymatic Target Predictions, Pharmacokinetics, Toxicity, Anti-Microbial and Anti-Inflammatory Studies of Bis-(2-methylindolyl) Methane Derivatives

    Current Enzyme Inhibition2021journal article

    View DOI
    23 cites

  44. Molecular docking, QSAR, pharmacophore modeling, and dynamics studies of some chromone derivatives for the discovery of anti-breast cancer agents against hormone-dependent breast cancer

    Journal of Biomolecular Structure and Dynamics2023journal article

    View DOI
    21 cites

  45. A viewpoint on angiotensin-converting enzyme 2, anti-hypertensives and coronavirus disease 2019 (COVID-19)

    Infectious Disorders - Drug Targets1970journal article

    View DOI
    20 cites

  46. An Insight Into the Anxiolytic Effects of Lignans (Phyllanthin and Hypophyllanthin) and Tannin (Corilagin) Rich Extracts of Phyllanthus amarus : An In-Silico and In-vivo approaches

    Combinatorial chemistry &amp; high throughput screening1970journal article

    View DOI
    20 cites

  47. Curcumin-integrated biopolymer films for active packaging: current trends and future directions

    Chemical Papers2025journal article

    View DOI
    19 cites

  48. Investigating the role of natural flavonoids in VEGFR inhibition: Molecular modelling and biological activity in A549 lung cancer cells

    Journal of Molecular Structure2025journal article

    View DOI
    19 cites

  49. Design, synthesis, QSAR modelling and molecular dynamic simulations of N-tosyl-indole hybrid thiosemicarbazones as competitive tyrosinase inhibitors

    Scientific Reports2024journal article

    View DOI
    19 cites

  50. The Rise of New Coronavirus Infection-(COVID-19): A Recent Update

    Eurasian Journal of Medicine and Oncology2020journal article

    View DOI
    19 cites

  51. Silver Nanoparticles (AgNPs) as a Double-Edged Sword: Synthesis, Factors Affecting, Mechanisms of Toxicity and Anticancer Potentials—An Updated Review till March 2025

    Biological Trace Element Research2025journal article

    View DOI
    18 cites

  52. Design, synthesis, in-vitro and in-silico studies of novel N-heterocycle based hydrazones as α-glucosidase inhibitors

    Bioorganic Chemistry2025journal article

    View DOI
    18 cites

  53. Synthesis, spectroscopic characterization, DFT analysis, antibacterial, antifungal, antioxidant, molecular docking, and ADME study of 3,4-dihydro-2H-napthalen-1-one tagged chalcone derivatives

    Journal of Molecular Structure2025journal article

    View DOI
    18 cites

  54. Cobalt(II) Complex Constructed from Pyrazinecarboxamide and Aromatic Carboxylic Acid: Synthesis, Single Crystal XRD Along with Computational Study

    Journal of Computational Biophysics and Chemistry2024journal article

    View DOI
    18 cites

  55. Synthesis, Molecular docking, Antioxidant, Anti-TB, and Potent MCF-7 Anticancer Studies of Novel Aryl-carbohydrazide Analogues

    Current Computer-Aided Drug Design1970journal article

    View DOI
    18 cites

  56. Synthesis, Computational Analysis, Antimicrobial, Antioxidant, Trypan Blue Exclusion Assay, β-hematin Assay and Anti-inflammatory Studies of some Hydrazones (Part-I)

    Current Computer-Aided Drug Design2023journal article

    View DOI
    17 cites

  57. Imidazo[1,2-a]pyridine-appended chalcone and Schiff base conjugates: synthetic, spectrophotometric, biological, and computational aspects

    Chemical Physics Impact2024journal article

    View DOI
    16 cites

  58. An efficient one-pot multicomponent, Amberlite IR120(H) catalyzed microwave-assisted synthesis of 1,2,4,5-tetrasubstituted-1 <i>H</i> -imidazoles: Plausible mechanism and antibacterial evaluation

    Synthetic Communications2023journal article

    View DOI
    16 cites

  59. One-Pot multicomponent synthesis of novel pyrazole-linked thiazolyl-pyrazolines: Molecular docking and cytotoxicity assessment on breast and lung cancer cell-lines

    Journal of Molecular Structure2025journal article

    View DOI
    15 cites

  60. Design, synthesis, in vitro, and in silico studies of 4-fluorocinnamaldehyde based thiosemicarbazones as urease inhibitors

    Scientific Reports2025journal article

    View DOI
    15 cites

  61. Chemical Composition of <i>Piper nigrum</i> L. Cultivar Guajarina Essential Oils and Their Biological Activity

    Molecules2024journal article

    View DOI
    15 cites

  62. Design, synthesis, in vitro, and in silico studies of novel isatin-hybrid hydrazones as potential triple-negative breast cancer agents

    RSC Advances1970journal article

    View DOI
    15 cites

  63. Synthesis, sar, molecular docking and anti-microbial study of substituted n-bromoamido-2-aminobenzothiazoles

    Current Computer-Aided Drug Design1970journal article

    View DOI
    15 cites

  64. Synthesis, in vitro, and in silico studies of 7-fluorochromone based thiosemicarbazones as α-glucosidase inhibitors

    Scientific Reports2025journal article

    View DOI
    14 cites

  65. Synthesis, Antibacterial, Antifungal, Antioxidant, DFT, Molecular Docking, and ADME Study of Two New Thiazole-Based Derivatives Featuring Nitrophenyl and Benzonitrile Functionalities

    Journal of Molecular Structure2025journal article

    View DOI
    14 cites

  66. Medicinal Plants - Chemical, Biochemical, and Pharmacological Approaches

    2023

    View DOI
    14 cites

  67. Identification of Anxiolytic Potential of Niranthin: In-vivo and Computational Investigations

    Natural Products and Bioprospecting1970journal article

    View DOI
    14 cites

  68. Microwave and ultrasound-assisted green protocols for 5-methylthiazole induced Betti bases: molecular docking, in-silico pharmacokinetics, and anticancer activity studies

    Green Chemistry Letters and Reviews2024journal article

    View DOI
    13 cites

  69. Synthesis of the chromone‐thiosemicarbazone scaffold as promising α‐glucosidase inhibitors: An in vitro and in silico approach toward antidiabetic drug design

    Archiv der Pharmazie2024journal article

    View DOI
    13 cites

  70. Development of Orally Active Anti-Inflammatory Agents: In Vivo and In Silico Analysis of Naphthalene-Chalcone Derivatives Based on 2-Acetyl-6-Methoxy Naphthalene

    Chemical Physics Impact2024journal article

    View DOI
    13 cites

  71. Targeting Infectious Coronavirus Disease 2019 (COVID-19) with Artificial Intelligence (AI) Applications: Evidence Based Opinion

    Infectious Disorders - Drug Targets2021journal article

    View DOI
    13 cites

  72. Design, synthesis, biological evaluation, and computational insights of 2-(Aryl)benzo[d]imidazo[2,1-b]thiazole-7-sulfonamide derivatives as potent antitubercular and antibacterial agents

    BMC Chemistry2025journal article

    View DOI
    12 cites

  73. First Report on the Chemical Composition, Antioxidant Capacity, and Preliminary Toxicity to <i>Artemia salina</i> L. of <i>Croton campinarensis</i> Secco, A. Rosário & PE Berry (Euphorbiaceae) Essential Oil, and In Silico Study

    Antioxidants2022journal article

    View DOI
    12 cites

  74. Inhibition of Plasmodium falciparum Fatty Acid Biosynthesis (FAS-II Pathway) by Natural Flavonoids: A Computer-Aided Drug Designing Approach

    Chemistry Africa2022journal article

    View DOI
    12 cites

  75. Green Synthesis of Substituted Dihydropyrimidin-2(1H)-one by Using Zinc Chloride /Acetic Acid Catalytic System

    Current Chinese Chemistry2021journal article

    View DOI
    12 cites

  76. Synthesis, Structural Elucidation, Supramolecular Assembly Exploration and DFT Study of a New Ketohydrazone Derivative

    Journal of Computational Biophysics and Chemistry2026journal article

    View DOI
    11 cites

  77. A Novel Xanthene-Containing Compound: Crystal Structure, Computational Study and Investigation of Non-Optical Properties

    Journal of Computational Biophysics and Chemistry2025journal article

    View DOI
    11 cites

  78. Synthesis, structure, DFT study and molecular docking inspection of spirobi[hexahydropyrimidine]-diones derivative

    Chemical Physics Impact2024journal article

    View DOI
    11 cites

  79. Biogenic Nanoparticles as Safer Alternatives for Gastric Ulcers: An Update on Green Synthesis Methods, Toxicity, and Their Efficacy in Controlling Inflammation

    Biological Trace Element Research2024journal article

    View DOI
    11 cites

  80. Targeting SmCB1: Perspectives and Insights to Design Antischistosomal Drugs

    Current Medicinal Chemistry2024journal article

    View DOI
    11 cites

  81. Antifibromyalgic Activity of Phytomolecule Niranthin: In-Vivo Analysis, Molecular Docking, Dynamics and DFT

    Journal of Computational Biophysics and Chemistry2024journal article

    View DOI
    11 cites

  82. Efficient Silica-OSO3H (SSA)-Catalyzed One-Pot Multicomponent Synthesis of 1,2,4,5-Tetrasubstituted 1H-Imidazoles: Molecular Docking, Antibacterial Activity, and Plausible Mechanism

    Russian Journal of Organic Chemistry2024journal article

    View DOI
    11 cites

  83. Theoretical and Anti-Klebsiella pneumoniae Evaluations of Substituted 2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide and Imidazopyridine Hydrazide Derivatives

    Molecules2023journal article

    View DOI
    11 cites

  84. Hemozoin (beta-hematin) Formation Inhibitors: Promising Target for the Development of New Antimalarials: Current Update and Future Prospect

    Combinatorial Chemistry & High Throughput Screening2022journal article

    View DOI
    11 cites

  85. Guerbet alcohol esters: Practical synthesis and applications

    Journal of the Indian Chemical Society2021journal article

    View DOI
    11 cites

  86. Experimental and Computational Insights into Bis-indolylmethane Derivatives as Potent Antimicrobial Agents Inhibiting 2,2-dialkylglycine Decarboxylase

    Current Enzyme Inhibition1970journal article

    View DOI
    11 cites

  87. Synthesis, biological evaluation, molecular docking and MD simulation studies of some new picolinohydrazide derivatives as cholinesterase inhibitors

    Journal of Molecular Structure2026journal article

    View DOI
    10 cites

  88. Unveiling the Ameliorative Effects of Phyto-selenium Nanoparticles (PSeNPs) on Anti-hyperglycemic Activity and Hyperglycemia Irradiated Complications

    BioNanoScience2025journal article

    View DOI
    10 cites

  89. MeltSerts technology (brinzolamide ocular inserts via hot-melt extrusion): QbD-steered development, molecular dynamics, in vitro, ex vivo and in vivo studies

    International Journal of Pharmaceutics2023journal article

    View DOI
    10 cites

  90. Formulation and evaluation of antidandruff shampoo using mannosylerythritol lipid (MEL) as a bio-surfactant

    Tenside Surfactants Detergents2022journal article

    View DOI
    10 cites

  91. Design, Synthesis, In Vitro, and In Silico Studies of 5‐(Diethylamino)‐2‐Formylphenyl Naphthalene‐2‐Sulfonate Based Thiosemicarbazones as Potent Anti‐Alzheimer Agents

    Archiv der Pharmazie2025journal article

    View DOI
    9 cites

  92. Synthesis, Anti‐Alzheimer Evaluation and In Silico Study of 4‐Methoxyphenyl)Sulfonyl Indole Hybrid Thiosemicarbazones

    Archiv der Pharmazie2025journal article

    View DOI
    9 cites

  93. Exploration of the anticancer efficacy of a novel 1,3-thiazole analog in an ehrlich ascites carcinoma model: <i>in vivo</i> and <i>in silico</i> insights into hepatorenal protective potentials <i>via</i> the modulation of apoptosis, oxidative stress and inflammation

    2025

    View DOI
    9 cites

  94. Molecular Hybrid Design, Synthesis, In Vitro Cytotoxicity, In Silico ADME and Molecular Docking Studies of New Benzoate Ester-Linked Arylsulfonyl Hydrazones

    Molecules2024journal article

    View DOI
    9 cites

  95. Synthesis, molecular docking and pharmacological evaluations of novel naphthalene-pyrazoline hybrids as new orally active anti-inflammatory agents

    Chemical Physics Impact2024journal article

    View DOI
    9 cites

  96. Synthesis, crystal structure investigation, and theoretical approaches to discover potential 6-bromo-3-cyanocoumarin as a potent inhibitor MetAP (methionine aminopeptidase) 2

    Chemical Physics Impact2024journal article

    View DOI
    9 cites

  97. Synthesis, In-Silico, In Vitro and DFT Assessments of Substituted Imidazopyridine Derivatives as Potential Antimalarials Targeting Hemoglobin Degradation Pathway

    Journal of Computational Biophysics and Chemistry2023journal article

    View DOI
    9 cites

  98. Recent Developments in Medicinal and In Silico Applications of Imidazopyridine Derivatives: Special Emphasis on Malaria, Trypanosomiasis, and Tuberculosis

    Chemistry Africa2022journal article

    View DOI
    9 cites

  99. Synthesis, Molecular Docking, and In vitro Antimycobacterial Studies on N'-arylidene-4-nitrobenzohydrazides

    Recent Advances in Anti-Infective Drug Discovery2022journal article

    View DOI
    9 cites

  100. Non-traditional oils with water-soluble substrate as cell growth booster for the production of mannosylerythritol lipids by Pseudozyma antarctica (ATCC 32657) with their antimicrobial activity

    Tenside Surfactants Detergents2022journal article

    View DOI
    9 cites

  101. The molecular diversity of 1,8-diaminonaphthalene in organic chemistry

    Combinatorial Chemistry & High Throughput Screening2020journal article

    View DOI
    9 cites

  102. Review on flow boiling heat transfer enhancement with nanofluids

    2014

    View DOI
    9 cites

  103. Waste derived-green and sustainable production of Sophorolipid

    Current Research in Green and Sustainable Chemistry1970journal article

    View DOI
    9 cites

  104. Synthesis, in silico studies and in vitro cytotoxicity evaluation of novel posaconazole derivative as a ALK TK inhibitor

    Journal of Taibah University for Science2024journal article

    View DOI
    8 cites

  105. Studies on chlorophenyl, thiophenyl, and biphenyl clubbed tetrahydro bipyrazole carbaldehydes: synthesis, antimicrobial and antioxidant activity, SAR study, in-silico pharmacokinetics, toxicity, and molecular modeling

    Chemical Physics Impact2024journal article

    View DOI
    8 cites

  106. Synthesis, Antioxidant, Antimicrobial Activities and Molecular Modeling analysis of some 5-Nitro-N-phenyl-3-(phenylamino)-1H-indazole-1-carboxamide Derivatives: Docking, SAR, Toxicity and Molecular Dynamics Analysis

    Chemical Physics Impact2024journal article

    View DOI
    8 cites

  107. Chemical Composition, Preliminary Toxicity, and Antioxidant Potential of Piper marginatum Sensu Lato Essential Oils and Molecular Modeling Study

    Molecules2023journal article

    View DOI
    8 cites

  108. In vitro and in silico analysis of synthesized N-benzyl indole-derived hydrazones as potential anti-triple negative breast cancer agents

    RSC Advances1970journal article

    View DOI
    8 cites

  109. Synthesis, human carbonic anhydrase I and II inhibition, and in silico studies of 2-ethoxy-6-formylphenyl [1,1′-biphenyl]-4-sulfonate derived thiosemicarbazones

    2025

    View DOI
    7 cites

  110. DFT Study, Molecular Docking, and Dynamics Simulation of Hydrazone-Based Compound

    2025

    View DOI
    7 cites

  111. Design, synthesis, structural characterization, in vitro anticancer activity, and in silico studies of some new hydroxylated and fluorinated-substituted hydrazone derivatives

    Chemical Physics Impact2025journal article

    View DOI
    7 cites

  112. A decade review of analysis of essential oils from genus Artocarpus: Its phytochemistry and pharmacology

    Pharmacological Research - Natural Products2024journal article

    View DOI
    7 cites

  113. Molecular Docking, QSAR, and ADME Studies of Some Pyrrolo[1, 2-a] benzimidazole-based quinones as Novel Topoisomerase 2 beta (TOP2β) Inhibitors

    Chemical Physics Impact2024journal article

    View DOI
    7 cites

  114. Synthesis of Novel Thiazolidine-4-One Derivatives, Their Cytotoxicity, Antifungal Properties, Molecular Docking and Molecular Dynamics

    Russian Journal of Bioorganic Chemistry2023journal article

    View DOI
    7 cites

  115. Pharmacological and In-Silico Investigations of Anxiolytic-like Effects of Phyllanthus Fraternus: A Probable Involvement of GABA-A Receptor

    Current Enzyme Inhibition2021journal article

    View DOI
    7 cites

  116. Design, synthesis, and in vitro and in silico studies of morpholine derived thiazoles as bovine carbonic anhydrase-II inhibitors

    RSC Advances1970journal article

    View DOI
    7 cites

  117. Pharmacological Aspects of Phyllanthus fraternus Standardized Extract (Rich in Lignans and Tannins) as a Pain Modulator

    The Open Pain Journal1970journal article

    View DOI
    7 cites

  118. In-vitro and in-silico study to assess anti breast cancer potential of N-tosyl-indole based hydrazones

    2025

    View DOI
    6 cites

  119. Thiazole derivatives as promising antimicrobial and antioxidant agents: insights from synthesis, bioactivity, and computational studies

    Journal of Sulfur Chemistry2025journal article

    View DOI
    6 cites

  120. Bio-Based Alkyd–Polyesteramide–Polyurethane Coatings from Castor, Neem, and Karanja Oils with Inherent Antimicrobial Properties for Enhanced Hygiene

    Coatings2025journal article

    View DOI
    6 cites

  121. Pregnancy Loss, Oropouche Virus and the Lessons from Pernambuco, Brazil

    Infez Med2024journal article

    6 cites

  122. Cheminformatics-driven prediction of BACE-1 inhibitors: Affinity and molecular mechanism exploration

    Chemical Physics Impact2024journal article

    View DOI
    6 cites

  123. Exploring phytochemistry, antioxidant capacity, and biological potential of essential oils obtained from Euphorbiaceae species

    Phytochemistry Reviews2024journal article

    View DOI
    6 cites

  124. Hydrazide–Hydrazones as Potential Antitubercular Agents: An Overview of the Literature (1999–2023)

    SynOpen2024journal article

    View DOI
    6 cites

  125. Synthesis and antiproliferative evaluation of novel 3,5,8-trisubstituted coumarins against breast cancer

    Future Medicinal Chemistry2024journal article

    View DOI
    6 cites

  126. Synthesis, Characterization, DFT, and In Silico Investigation of Two Newly Synthesized β-Diketone Derivatives as Potent COX-2 Inhibitors

    Bioengineering2023journal article

    View DOI
    6 cites

  127. Antimalarial Hemozoin Inhibitors (β-Hematin Formation Inhibition): Latest Updates

    Combinatorial Chemistry & High Throughput Screening2022journal article

    View DOI
    6 cites

  128. Optimization of the primary purification process of extracting sphorolipid from the fermentation broth to achieve a higher yield and purity

    Tenside Surfactants Detergents2022journal article

    View DOI
    6 cites

  129. Design, synthesis, and computational insights into 3-acetyl-8-methoxy coumarin hybrids as potential anti-alzheimer’s agents

    2025

    View DOI
    5 cites

  130. Synthesis, characterization, computational and biological evaluation of pyrazole hydrazones as promising anti-inflammatory agents

    Scientific Reports2025journal article

    View DOI
    5 cites

  131. Potential Antimicrobial properties of cytosine β-D-riboside derivatives through molecular dynamics and molecular docking exploration with bacterial and fungal proteins

    Aspects of Molecular Medicine2025journal article

    View DOI
    5 cites

  132. Hydrazide-Hydrazone Derivatives and Their Antitubercular Activity

    2025

    View DOI
    5 cites

  133. A Comprehensive Insight into the Phytochemistry, Pharmacology, and Therapeutic Potential of Digitalis purpurea L.

    Asian Journal of Organic Chemistry2025journal article

    View DOI
    5 cites

  134. Methyl Eugenol: Potential to Inhibit Oxidative Stress, Address Related Diseases, and Its Toxicological Effects

    Future Integrative Medicine2024journal article

    View DOI
    5 cites

  135. Chemical Composition and In Vitro and In Silico Biological Activities of Myrciaria tenella (DC.) O.Berg (Myrtaceae) Essential Oil from Brazil

    2024

    View DOI
    5 cites

  136. In Silico Studies, Design and Synthesis of Novel Fused Pyrimidine Derivatives as a DNA Gyrase Inhibitor and Antibacterial Activity Against Quinolone Resistant Escherichia Coli

    Journal of Computational Biophysics and Chemistry2023journal article

    View DOI
    5 cites

  137. Synthesis, In Silico and In Vitro Antimycobacterial Studies on Substituted Benzofuran Derivatives

    Russian Journal of Bioorganic Chemistry2022journal article

    View DOI
    5 cites

  138. Synthesis, Structure, Bioactivity and Computational Avenue to Identify Structural Requirements of Novel 2-Imino-4-thiazolidinones as Anti-Tumour Agents

    Russian Journal of Bioorganic Chemistry2022journal article

    View DOI
    5 cites

  139. Improved adsorptive purification and effective separation of acidic and lactonic sophorolipid biosurfactant

    Journal of the Indian Chemical Society2022journal article

    View DOI
    5 cites

  140. Furan–thiazole hydrazone scaffolds as promising antitubercular and antibacterial agents: synthesis, characterization, bioevaluation and computational analysis

    RSC Advances1970journal article

    View DOI
    5 cites

  141. Mechanistic QSAR modeling derived virtual screening, drug repurposing, ADMET and in - vitro evaluation to identify anticancer lead as lysine-specific demethylase 5a inhibitor

    Journal of Biomolecular Structure and Dynamics2025journal article

    View DOI
    4 cites

  142. PEG‐400 Mediated Synthesis of Benzo[ <i>d</i> ]Imidazo[2,1‐ <i>b</i> ]Thiazoles as Bioactive Scaffolds: Antibreast Cancer Potential, EGFR Inhibition, Antioxidant Study, Molecular Docking, and DFT Insights

    2025

    View DOI
    4 cites

  143. Nanobots: A Revolutionary Technology in the Development of Pharmaceuticals

    BioNanoScience2025journal article

    View DOI
    4 cites

  144. Structural, dynamic behaviour, in-vitro and computational investigations of Schiff’s bases of 1,3-diphenyl urea derivatives against SARS-CoV-2 spike protein

    Scientific Reports2024journal article

    View DOI
    4 cites

  145. Catalyst-Free, One-Pot, Three-Component Synthesis of 5-Amino-1,3-diphenyl-1H-pyrazole-4-carbonitriles in Green Media, and Evaluation of Their Biological Activities

    Russian Journal of Bioorganic Chemistry2024journal article

    View DOI
    4 cites

  146. In Vivo and In Silico Molecular Modeling Studies of Newly Synthesized Pyrazoles for Their Anti-Inflammatory and Analgesic Properties

    Journal of Computational Biophysics and Chemistry2024journal article

    View DOI
    4 cites

  147. QSAR and docking based lead optimization of nitrogen heterocycles for enhanced prostaglandin EP2 receptor agonistic potency

    Chemical Physics Impact2024journal article

    View DOI
    4 cites

  148. Computational studies and structural insights for discovery of potential natural aromatase modulators for hormone-dependent breast cancer

    BioImpacts2024journal article

    View DOI
    4 cites

  149. Variation in the Chemical Composition of Endemic Specimens of Hedychium coronarium J. Koenig from the Amazon and In Silico Investigation of the ADME/Tox Properties of the Major Compounds

    Plants2023journal article

    View DOI
    4 cites

  150. L-Proline Catalyzed Knoevenagel Condensation of Aldehydes with Active Methylene Compounds and Their Molecular Modeling Studies for Anti-SARS CoV-2 Potentials

    Current Enzyme Inhibition2022journal article

    View DOI
    4 cites

  151. Improved synthesis of sophorolipid biosurfactants using industrial by-products and their practical application

    Tenside Surfactants Detergents2022journal article

    View DOI
    4 cites

  152. Unveiling Naturally Occurring Green Tea Polyphenol Epigallocatechin-3-Gallate (EGCG) Targeting Mycobacterium DPRE1 for Anti-Tb Drug Discovery

    Engineering Proceedings2021conference paper

    View DOI
    4 cites

  153. Greener Synthesis, In-Silico and Theoretical Analysis of Hydrazides as Potential Antituberculosis Agents (Part 1)

    The 25th International Electronic Conference on Synthetic Organic Chemistry2021conference paper

    View DOI
    4 cites

  154. A Viewpoint on Angiotensin-Converting Enzyme 2, Anti-Hypertensives and Coronavirus Disease 2019 (COVID-19)

    2021

    View DOI
    4 cites

  155. Synthesis of (2-hydroxyl-3-butoxyl) propyl-succinyl-chitosan – An amino sugar anionic surfactant under microwave irradiation and its application

    2021

    View DOI
    4 cites

  156. Synthesis and in-silico identification of new bioactive 1,3,4-oxadiazole tagged 2,3-dihydroimidazo[1,2-a]pyridine derivatives

    Current Bioactive Compounds1970journal article

    View DOI
    4 cites

  157. Anticancer potential of 1,2,3-triazole-tethered isonicotinate hybrids: Synthesis, in-silico studies, in-vitro studies and MD simulation

    Journal of Molecular Structure2026journal article

    View DOI
    3 cites

  158. Synthesis, antifungal activity, molecular docking and DFT analysis of new (E)-4-(4-aryl)-2-(2-(1-(2,4-dimethoxyphenyl)ethylidene)hydrazineyl)thiazoles: An integrated experimental and theoretical study

    Journal of Molecular Structure2025journal article

    View DOI
    3 cites

  159. Targeting PI3K/AKT/mTOR signalling pathway in non-small-cell lung carcinoma: Exploring promising bioactive natural compounds as anti-cancer agents

    Chemical Physics Impact2025journal article

    View DOI
    3 cites

  160. Acidulated Soapstock as a Carbon Source for the Production of Mannosylerythritol Lipids by Pseudozyma antarctica ATCC 2706

    Applied Sciences2024journal article

    View DOI
    3 cites

  161. Analysis of Chemical Composition, Antioxidant Activity, and Toxicity of Essential Oil from Virola sebifera Aubl (Myristicaceae)

    Molecules2024journal article

    View DOI
    3 cites

  162. Carbonylbis(hydrazine‐1‐carbothioamide) derivatives as a new class of α‐glucosidase inhibitors and their mechanistic insights via molecular docking and dynamic simulations

    Archiv der Pharmazie2024journal article

    View DOI
    3 cites

  163. Synthesis of chromone-based thiosemicarbazone as selective chemosensor for cyanide ion and its DFT calculation studies

    Supramolecular Chemistry2024journal article

    View DOI
    3 cites

  164. Structure-based drug design for Protein Arginine Deiminase Type IV (PAD4) receptor: Chemoinformatics Approach

    Chemical Physics Impact2024journal article

    View DOI
    3 cites

  165. Extensive Multiple 2D-/3D-QSAR Modeling, Molecular Docking and Pharmacophoric Approaches for Piperazinylquinoline Derivatives as Respiratory Syncytial Virus Fusion Inhibitors

    Recent Advances in Anti-Infective Drug Discovery2023journal article

    View DOI
    3 cites

  166. Synthesis and Anti-Tuberculosis Activity of Substituted 3,4-(dicoumarin-3-yl)-2,5-diphenyl Furans and Pyrroles

    Engineering Proceedings2022conference paper

    View DOI
    3 cites

  167. Greener Synthesis of Jasminaldehyde via Cross Aldol Condensation Reaction Using Recyclable Phase Transfer Catalysis and its Cosmetic Application

    Letters in Applied NanoBioScience2022journal article

    View DOI
    3 cites

  168. Modulation of Prostaglandin E2 with Natural Products for Better Management of Pain and Inflammation

    Current Enzyme Inhibition2022journal article

    View DOI
    3 cites

  169. Antinociceptive Investigations of Niranthin in Complete Freund’s Adjuvant- induced Chronic Pain in Mice

    Recent Advances in Inflammation & Allergy Drug Discovery2022journal article

    View DOI
    3 cites

  170. 1,2,5-Thiadiazole Scaffold: A Review on Recent Progress in Biological Activities

    Combinatorial Chemistry & High Throughput Screening2022journal article

    View DOI
    3 cites

  171. A sustainable approach towards the three-component synthesis of unsubstituted 1H-imidazoles in the water at ambient conditions

    Journal of Asian Natural Products Research1970journal article

    View DOI
    3 cites

  172. Anti-inflammatory activity of Silver Nanoparticles (AgNPs): An Updated Systematic review from in vivo, and in vitro studies

    Inflammopharmacology2026journal article

    View DOI
    2 cites

  173. Synthesis, Biological Evaluation and Molecular Docking Studies of Novel 4‐Propylsulfonylpiperazines‐Based Thiosemicarbazones as Ecto‐5′‐Nucleotidase and NTPDase Inhibitors

    Archiv der Pharmazie2025journal article

    View DOI
    2 cites

  174. Green Synthesis of Pyrazole Linked Thiazole Derivatives With Enhanced Anti‐Breast Cancer Activity: Water Extract of Banana Peel‐Mediated Protocol, Anticancer Screening, Epidermal Growth Factor Receptor Inhibition, In Silico Absorption–Distribution–Metabolism–Excretion and Density Functional Theory Calculations

    Chemistry & Biodiversity2025journal article

    View DOI
    2 cites

  175. Phytochemistry, pharmacological insights, and food science applications of natural bioactive compounds from <i>Ocimum</i> species with a focus on essential oils

    Food Frontiers2025journal article

    View DOI
    2 cites

  176. A Comprehensive Review on Immunoregulatory Effects of Phytochemicals

    Current Drug Discovery Technologies2025journal article

    View DOI
    2 cites

  177. Recent Progress in Synthetic and Natural Catechol-O-methyltransferase Inhibitors for Neurological Disorders

    ACS Omega2024journal article

    View DOI
    2 cites

  178. Synthesis, biological evaluation, and molecular modelling of substituted thiazolyl thiourea derivatives: A new class of prolyl oligopeptidase inhibitors

    International Journal of Biological Macromolecules2024journal article

    View DOI
    2 cites

  179. QSAR modelling to predict structural features of certain sulfonamide as Urokinase-type Plasminogen Activator inhibitors

    Chemical Physics Impact2024journal article

    View DOI
    2 cites

  180. Correlation of Fatty Acid Chain Length Used in the Biscuit Formulation with the Biscuits Texture Profile

    2024

    View DOI
    2 cites

  181. Synthesis, Characterization, ‘ADMET-SAR’ Prediction, DPPH Assay, and Anti-Mycobacterium Study of 4-[(substituted benzyl) amino]benzo hydrazides and its Hydrazones as the Acyl-CoA Carboxylase, AccD5 Inhibitors

    Current Computer-Aided Drug Design2023journal article

    View DOI
    2 cites

  182. Advances in the development of a 3D-printed nutraceutical delivery platform

    Nutraceuticals2023book chapter

    View DOI
    2 cites

  183. Novel quinolinyl-thiazole hybrid candidates bearing N-methyl piperazine as potential anti-breast cancer agents: synthesis, biological evaluation and computational studies

    RSC Advances1970journal article

    View DOI
    2 cites

  184. Synthesis, antidiabetic evaluation, and computational modeling of 3-acetyl-8-ethoxy coumarin derived hydrazones and thiosemicarbazones

    RSC Advances1970journal article

    View DOI
    2 cites

  185. Synthesis of New Pyrazolo Pyrimidine Disazo Dyes, Theoretical and Experimental Comparison of their Characteristic Properties and in silico Prediction of their Possible Antibacterial Activity

    Journal of Computational Biophysics and Chemistry2026journal article

    View DOI
    1 cites

  186. Bioactivity Profiling of Coronarin A and Villosin Isolated From <i>Hedychium coronarium</i> J. Koenig: Acaricidal, Nematicidal, and Antifungal Potential

    Chemistry &amp; Biodiversity2026journal article

    View DOI
    1 cites

  187. Discovery of New Hydrazonothiazolines as Bovine and HumanCarbonic Anhydrase-II Inhibitors: In-vitro, Kinetics, Selectivity andMolecular Dynamics Exploration

    2026

    View DOI
    1 cites

  188. Synthesis, Spectral Characterization, and Biological Evaluation of 2-(1-(4-(1H-Imidazol-1-yl)phenyl)ethylidene)hydrazineyl)-4-arylthiazoles: Antibacterial, Antifungal, Molecular Docking, and DFT Studies

    Journal of Molecular Structure2025journal article

    View DOI
    1 cites

  189. Concise experimental and DFT study of newly synthesized 5,17-di(2-antracenylazo)-25,27-[1,3-ethylene-bis(aminocarbonylmethoxy)]-26,28-dihydroxycalix[4]arene

    2025

    View DOI
    1 cites

  190. Synthesis, Spectroscopic Characterization, Structural Analysis, Antimycobacterial Study, Molecular Docking, DFT, and ADME Studies of Novel Hybrid Pyrrole–Pyrazole–Piperazine Chalcone

    ACS Omega2025journal article

    View DOI
    1 cites

  191. Therapeutic Bioactivities and Chemical Composition Analysis of Rhizome Oleoresin of Hedychium coronarium Collected from Uttarakhand, India

    Combinatorial Chemistry & High Throughput Screening2025journal article

    View DOI
    1 cites

  192. Molecular Docking, Dynamics, and Cytotoxicity Assessment of Pyrazolo[1,5‐ <i>a</i> ]pyrimidine Derivatives Against Breast Cancer

    2025

    View DOI
    1 cites

  193. In Silico Molecular Docking and Molecular Dynamics Analysis of Antimicrobial Triazole Derivatives: Insights from Synthesis, Computational and In Vitro Studies

    Combinatorial Chemistry & High Throughput Screening2025journal article

    View DOI
    1 cites

  194. Editorial: Medicinal chemistry for neglected tropical diseases using in-vitro, in-vivo and in silico approaches

    2025

    View DOI
    1 cites

  195. Design, Synthesis, Computational Studies and Evaluation of Novel Hybrid Bipyrimidine Analogues for Anticancer Activity against MCF-7 and A549 Cell Lines

    Journal of Computational Biophysics and Chemistry2025journal article

    View DOI
    1 cites

  196. Transdermal delivery of antibacterial peptides in the management of methicillin-resistant Staphylococcus aureus

    Current Opinion in Pharmacology2025journal article

    View DOI
    1 cites

  197. Essential oils from Brazilian plants: A literature analysis of anti-inflammatory and antimalarial properties and <i>in silico</i> validation

    Open Chemistry2025journal article

    View DOI
    1 cites

  198. Biological Evaluation and Molecular Docking Study of (E)-N-(2-Aminophenyl)-3-(quinolin-4-yl)acrylamides as Potential Anticolon Cancer Agents

    2025

    View DOI
    1 cites

  199. Synergizing GA-XGBoost and QSAR modeling: Breaking down activity aliffs in HDAC1 inhibitors

    Journal of Molecular Graphics and Modelling2025journal article

    View DOI
    1 cites

  200. A review on efficacy of phytochemicals in the treatment of trypanosomiasis

    Medicinal Chemistry Research2025journal article

    View DOI
    1 cites

  201. A New Green and Efficient Method for Pyranopyrazoles Synthesis in a Single Pot Using Multiple Components, In Silico Pharmacokinetics with Cytotoxic Assessments

    2025

    View DOI
    1 cites

  202. A Quantum-Mechanical Method Reveals the Potential Basis of Antioxidant Activities of Phytomolecules from Jasminum Species: Isolation, Spectral Characterization, DFT, and In Vitro Studies

    2025

    View DOI
    1 cites

  203. EFFECTS OF ARTIFICIAL SWEETENERS ON HUMAN HEALTH

    2025

    View DOI
    1 cites

  204. Cheminformatics approaches to predict the bioactivity and to discover the pharmacophoric traits crucial to block NF-κB

    Chemical Physics Impact2024journal article

    View DOI
    1 cites

  205. Investigation of Novel Thiazolin-2,4-diones: Synthesis, Biological Evaluation, and Docking Studies for Enhanced Insights

    Russian Journal of Bioorganic Chemistry2024journal article

    View DOI
    1 cites

  206. Reviewing the Synthesis and Clinical Application of FDA-approved Anticancer Medications

    Current Topics in Medicinal Chemistry2024journal article

    View DOI
    1 cites

  207. Synthesis, In Vitro and In Silico Evaluation of 3-(4, 5-Diphenyl-4H-1,2,4-triazol-3-yl)pyridine Derivatives As Potential Antimicrobial Agents

    Russian Journal of Bioorganic Chemistry2024journal article

    View DOI
    1 cites

  208. Studies on N-(6-Indazolyl) benzenesulfonamide Derivatives as Potential Anticancer Agents: Integrating Synthesis, In silico Docking, and Molecular Dynamics Simulations

    Journal of Computational Biophysics and Chemistry2024journal article

    View DOI
    1 cites

  209. Inter-esterified blends of Palm kernel oil, Palm oil, Palm oil Fractions and their derivatives as low Trans and low-cost fats as potential cocoa butter substitutes

    Research Journal of Pharmacy and Technology2024journal article

    View DOI
    1 cites

  210. Editorial: Investigation of the biological properties of natural products using experimental approaches and in silico methods

    Frontiers in Chemistry2024journal article

    View DOI
    1 cites

  211. Synthesis, Computational, and In Vitro Antimycobacterial Studies on Benzofuran based Sulphonamide Derivatives (Part II)

    Russian Journal of Bioorganic Chemistry2023journal article

    View DOI
    1 cites

  212. In silico Methods for Evaluating the Mode of Interaction of Nanoparticles with Molecular Target

    Nanobiomaterials2023book chapter

    1 cites

  213. A Chitosan Hydrochloride Mediated, Simple and Efficient Approach for the Synthesis of Hydrazones, their in vitro Antimycobacterial Evaluations, and Molecular Modeling Studies (Part III)

    SynOpen2023journal article

    View DOI
    1 cites

  214. Antinociceptive Investigations of Rubiadin in Chronic pain induced by Freund’s adjuvant in mice

    Research Journal of Pharmacy and Technology2023journal article

    View DOI
    1 cites

  215. Isopropyl Ricinoleate, A Potential Alternative to Isopropyl Myristate: Experimental and Computational Evaluation

    Current Cosmetic Science2022journal article

    View DOI
    1 cites

  216. Review of the importance of Hydrazide and its Derivatives in Organic synthesis

    2021

    1 cites

  217. Synthesis of (2-hydroxyl-3-butoxyl) propyl-succinyl-chitosan (HBP-SCCHS) – an amino sugar anionic surfactant under Microwave Irradiation and its application;(TJPS-2021-0086.R1)

    2021

    1 cites

  218. Nano strategies in diagnosis and treatment of inflammatory Hyperlagesia

    Current Nanomaterials2021journal article

    View DOI
    1 cites

  219. Design and Analysis of double- stacked Heat Exchanger for Brewery Application

    2020

    View DOI
    1 cites

  220. Neuroprotective Potential of Carotenoids

    Carotenoids1970book chapter

    View DOI
    1 cites

  221. Nanotechnology-based approaches for covid-19: A path forward

    Current Nanomaterials1970journal article

    View DOI
    1 cites

  222. Synthesis, anticancer activity, molecular docking and DFT studies of new semicarbazide derivatives from clopidogrel as enolase-1 inhibitors

    Journal of Molecular Structure2026journal article

    View DOI
    0 cites

  223. Selective Targeting of SARS-CoV-2 Spike Protein by Isatin-Hydrazide Hybrids: Synergistic In vitro and Molecular Dynamics Approaches

    Current Topics in Medicinal Chemistry2026journal article

    View DOI
    0 cites

  224. Discovery of 2-(2-benzylidenehydrazinyl)thiazole derivatives with potent antimicrobial and antibiofilm activity

    Journal of Molecular Structure2026journal article

    View DOI
    0 cites

  225. Synthesis, biological evaluation, molecular docking and molecular dynamic simulation studies of new 1,3,4-thiadiazole and 1,2,4-triazole derivatives as enolase-1 inhibitors

    Journal of Molecular Structure2026journal article

    View DOI
    0 cites

  226. Corrigendum to “Development of curcumin integrated smart pH indicator, antibacterial, and antioxidant waste derived Artocarpus lakoocha starch-based packaging film” Int. J. Biol. Macromol., Volume 275, Part 2, August 2024, 133827

    2026

    View DOI
    0 cites

  227. Piperidinyl Linked Pyrazole Chalcones as Potent Antitubercular Candidates: Experimental and Computational Study

    Journal of Molecular Structure2026journal article

    View DOI
    0 cites

  228. Development of Substituted 2‐(2‐(Phenyl)hydrazono)‐5,5‐Dimethylcyclohexane‐1,3‐diones as Possible COX‐2 Inhibitors

    ChemistrySelect2026journal article

    View DOI
    0 cites

  229. Synthesis, Characterization, Molecular Docking, and DFT Studies of 2,3,5-Trisubstituted-1,3,4-Oxadiazol-3(2H)-yl Methanone Derivatives

    Journal of Computational Biophysics and Chemistry2026journal article

    View DOI
    0 cites

  230. Exploring Green Tea Polyphenols Against Penicillin-Binding Proteins (PBPs) as Prospective Targets for Peptic Ulcer Treatment: In Silico Analysis

    2025

    View DOI
    0 cites

  231. Smart Assistance for Linux Beginners: A MultiModel Chatbot Approach

    2025

    View DOI
    0 cites

  232. Exploring 5-Nitro-N-phenyl-3-(phenylamino)-1H-indazole-1-carboxamide (5-NPIC) Derivatives as Anticancer Agents: Synthesis, Docking and Molecular Dynamics Insights

    Journal of Computational Biophysics and Chemistry2025journal article

    View DOI
    0 cites

  233. Synthesis and Antimicrobial Screening of Some Thiazolidin-4-one Derivatives

    2025

    View DOI
    0 cites

  234. Synthesis and Biological Assessment of Novel Derivatives of 2-Oxo-tetrahydropyrimidine-5-carboxamides

    2025

    View DOI
    0 cites

  235. Referee report. For: The potential effects of cranberry extract on indomethacin-induced gastric ulcer in rats [version 1; peer review: 1 approved]

    2025

    View DOI
    0 cites

  236. Unveiling promising bioactives for breast cancer: a novel approach for herbal-based drug discovery

    Phytochemistry Reviews2024journal article

    View DOI
    0 cites

  237. Extraction of essential oil from Radhuni (Carum roxburghianum) via novel techniques with Process intensification and characterization

    Letters in Applied NanoBioScience2024journal article

    0 cites

  238. Morpholine-tethered Novel Hydrazones as Promising Non-peptidic Prolyl Oligopeptidase (POP) Inhibitors: Synthesis In Vitro and In Silico Studies

    Current Medicinal Chemistry2024journal article

    View DOI
    0 cites

  239. Evaluation of active carbon under sodic soil after gypsum and bio- compost application

    2024

    View DOI
    0 cites

  240. In Vitro and In Silico Evaluation of 2-(1H-Benzo[d]imidazol-2-yl)-3-(4-(piperazin-1-yl)phenyl)propanenitrile as Epidermal Growth Factor Receptor Tyrosine Kinase Inhibitors

    Russian Journal of Bioorganic Chemistry2024journal article

    View DOI
    0 cites

  241. An Ethnopharmacological Survey on Medicinally Important Plants of Genus Salvia

    Combinatorial Chemistry &amp; High Throughput Screening2024journal article

    View DOI
    0 cites

  242. Unusual manifestations of syphilis in HIV

    2024

    View DOI
    0 cites

  243. Design, Synthesis, In-Vitro and In-Silico Studies of Novel N-Heterocycle Based Hydrazones as Α-Glucosidase Inhibitors

    2024

    View DOI
    0 cites

  244. Design, Synthesis, in Vitro and Molecular Docking-Dynamics Studies of 5-(Diethylamino)-2-Formylphenyl Naphthalene-2-Sulfonate Based Thiosemicarbazones as Potent Anti-Alzheimer Agents

    2024

    View DOI
    0 cites

  245. Mechanistic QSAR analysis to predict the binding affinity of diverse heterocycles as selective cannabinoid 2 receptor inhibitor

    Journal of Taibah University for Science2023journal article

    View DOI
    0 cites

  246. CCDC 1475293: Experimental Crystal Structure Determination

    2023

    View DOI
    0 cites

  247. CCDC 1484656: Experimental Crystal Structure Determination

    2023

    View DOI
    0 cites

  248. Unveiling the Synthesis and Photophysical Properties of 2,2′-[Iminobis(2,1-ethanediyliminomethylene)]diphenol and Its Zinc Complexes

    Engineering Proceedings2023conference paper

    View DOI
    0 cites

  249. Theoretical and Experimental Investigations for Identification of Anaphylactic Lymphoma Kinase inhibitors

    Physical Chemistry Research2023journal article

    0 cites

  250. Valorization of Rice Bran Fatty Acid Distillate: A Green Approach to Ethanol-Based Biodiesel Production Using Eversa® Transform as a Recyclable Catalyst

    Physical Chemistry Research2023journal article

    0 cites

  251. One-Pot Synthesis of Knoevenagel Condensation Products Using Boric Acid as a Catalyst

    Engineering Proceedings2023journal article

    View DOI
    0 cites

  252. Synthesis, In-silico and In-vitro Antimycobacterial Studies on Novel Benzofuran Derivatives

    Current Enzyme Inhibition2023journal article

    View DOI
    0 cites

  253. Review of: "Flavocillin: a potent TrxR and OATP inhibitor"

    2023

    View DOI
    0 cites

  254. Contributors

    2023

    View DOI
    0 cites

  255. Structural Insight into 2-Aryl-4-Quinoline Carboxylic Acid-Based Dihydroorotate Dehydrogenase (DHODH) and its Potential Anti-SARS-CoV-2 Activity Through Pharmacophore Modeling, Multidimensional QSAR, ADME, and Docking Studies

    Physical Chemistry Research2022journal article

    0 cites

  256. In Silico Investigations of Dihydrophenanthrene Derivatives as Potential Inhibitors of SARS-CoV-2

    Medical Sciences Forum2022journal article

    View DOI
    0 cites

  257. Effect of relative water content in rice genotypes after gypsum and bio-compost amended sodic soil

    2022

    View DOI
    0 cites

  258. Waste derived-green and sustainable production of Sophorolipid

    Current Research in Green and Sustainable Chemistry2021journal article

    View DOI
    0 cites

  259. Formulation of effervescent tablet detergent compact with unique chemical compositions

    2021

    0 cites

  260. Formulation of Effervescent Compact Detergent Tablets with Unique Chemical Compositions

    Engineering Proceedings2021conference paper

    View DOI
    0 cites

  261. Naturally occuring Green tea polyphenols as anti-mycobacterial agents

    2021

    0 cites

  262. Naturally Occurring Green Tea Polyphenols as Anti-Mycobacterial Agents

    Medical Sciences Forum2021conference paper

    View DOI
    0 cites

  263. A Viewpoint on Potential Biomarkers for Infectious COVID-19 Severity: An Updated Literature Survey

    Infectious Disorders - Drug Targets2021journal article

    View DOI
    0 cites

  264. Synthesis of (2-hydroxyl-3-butoxyl) propyl-succinyl-chitosan (HBP-SCCHS) – an amino sugar anionic surfactant under Microwave Irradiation and its application

    Thai Journal of Pharmaceutical Sciences2021journal article

    0 cites

  265. Chronic Inflammatory Pain Modulating Potential of Rubiadin: In-vivo, In-vitro and In-silico Investigations

    Current Indian Science1970journal article

    View DOI
    0 cites

  266. Schiff base clubbed benzothiazole: synthesis, potent antimicrobial and MCF-7 anticancer activity, DNA cleavage and computational study

    Journal of Biomolecular Structure and Dynamics1970journal article

    View DOI
    0 cites