All Stories

  1. A complete perspective on lanthanide coordination complexes: Fundamentals, mechanisms and applications
  2. Monte Carlo-based SMILES-driven QSPR modeling of Organic Chromophores across the visible-to- NIR spectral range
  3. Structure–property correlations in terbium complexes: Influence of 1,10-phenanthroline substituents and fluorinated β-diketones on green emission
  4. Engineered CuO nanoparticles: A multifunctional platform for corrosion resistance, photocatalysis, and antibacterial activity
  5. Structure–property relationships in Orange–red emissive samarium(III) complexes incorporating fluorinated β-diketones and functionalised bipyridine ligands
  6. Tailoring photoluminescence in Sm(III) β-Diketonates: Impact of Heteroaryl substitution on optical and electronic behavior
  7. Fabrication, structural, elucidation and biological evaluation of bioactive macrocyclic complexes through in-vitro and in-silico approaches
  8. DFT-Assisted Optical Emission Analysis of Green Luminescent Terbium(III) Mononuclear Complexes with BPTD and N-Donor Chelates
  9. Judd–Ofelt analyses and luminescence behavior of visible emitting trivalent Eu (III) complexes synthesized from 1-(4-bromophenyl)-4,4,4-trifluorobutane-1,3-dione and distinct ancillary ligands
  10. Viscosity-sensitive NIR probe for detecting cellular state transitions in Normal, Cancer and apoptotic cells
  11. Synthesis and characterization of near-white luminescent Tb(III) β-diketonates for potential OLED applications: Influence of neutral co-ligands on optical and electronic properties
  12. Synthesis, Characterization, and Photometric Studies of Tb(III) Complexes With 6‐Ethyl‐4‐oxo‐4 H ‐1‐benzopyran‐3‐carboxaldehyde and Auxiliary Ligands
  13. Samarium(III) complexes as potential orange-red light emitters: A comprehensive study on the influence of coordination environment
  14. Advancements in carbon capture and utilization technologies: Transforming CO2 into valuable resources for a sustainable carbon economy
  15. Regioselective synthesis, structural investigation and binding behavior of 6-aroyl-7-aryl-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5- a ]pyrimidines with BSA using various spectroscopic and ...
  16. From mononuclear to pyrazine-bridged dinuclear samarium( iii ) complexes: role of fluxidentate coordination in luminescent and thermal behavior
  17. UV-induced near-white visible emission in dinuclear Tb( iii ) complexes: a photophysical, theoretical and computational study on fluxidentate ligand bridging and coordination geometry
  18. System of self-consistent models synergistic or antagonistic with correlation intensity index: a combined perusal using MAO-A inhibitors
  19. Fluorinated analogues of β-diketone based samarium complexes: Photophysical properties and role of N-donor secondary ligands
  20. Ancillary ligand-dependent photophysical modulation in Tb(III) complexes with halogenated diketones
  21. Designing luminescent Eu(III) complexes with heteroligands: A comprehensive spectroscopic, DFT and Judd-Ofelt study
  22. Judd-Ofelt analysis and optoelectronic properties of red-emissive Eu(III) complexes with fluorinated β-diketones and N-heterocyclic ligands
  23. Quinoxaline appended 1,2,3-triazole: A “turn off” fluorescent probe for selective Fe3+ ion recognition
  24. Development of Template‐Assisted Biologically Active Macrocyclic Complexes: Structural Characterization and Apoptotic Studies
  25. DFT studies and experimental characterization of Eu3+ complexes in different coordinating environment: A comprehensive approach to luminescence and applications in display technologies
  26. Decoding ZnO: multifunctional properties via theory and experiment
  27. High performance of synergistic reinforced natural rubber with kewda fiber ( Pandanus odoratissimus ) and carbon black: thermal, morphological and statistically optimized mechanical studies
  28. Optimizing europium(III) ion luminescence via β-diketone and auxiliary ligands: analysis of optoelectronic features and Judd-Ofelt parameters
  29. Brominated β-diketone-driven luminescence in europium(III) complexes: insights from spectroscopic, DFT and Judd-Ofelt analysis
  30. Design and synthesis of new 1,4-naphthoquinones appended sulfenylated thiazoles as cyclooxygenase II inhibitors: Exploring the utility in the development of anticancer agents
  31. White light emission from a ternary dysprosium complex: Energy transfer and ligand-driven modulation
  32. Influence of carbon black and cotton fiber on the mechanical and thermal properties of natural rubber composites: a statistical optimization using Central composite design
  33. Exploring the Structural Versatility and Dynamic Behavior of Acyl/Aroyl Hydrazones: A Comprehensive Review
  34. Exploring the influence of emissive centers in mono and dinuclear europium(III) complexes for advance lighting applications: Synthesis, characterization and computational modelling
  35. Syzygium cumini leaf extract mediated green synthesis of ZnO nanoparticles: A sustained release for anticancer, antimicrobial, antioxidant, and anti-corrosive applications
  36. Synthesis, C-N/N-N bond conformational analysis and evaluation of naphtho[2,3-d][1,2,3]triazole-4,9-dione tethered N-acyl hydrazones as α-amylase inhibitors: Insights from molecular modeling and ADMET analysis
  37. Key molecular scaffolds in the development of clinically viable α-amylase inhibitors
  38. Colorimetric reversibility: Aqueous phase recognition of cyanide using smart phone-based device with real sample analysis
  39. An indolium inspired portable colorimetric sensor for cyanide recognition in environmental samples with smartphone integration
  40. Design and development of sulfenylated 5-aminopyrazoles as inhibitors of acetylcholinesterase and butyrylcholinesterase: exploring the implication for Aβ1–42 aggregation inhibition in Alzheimer's disease
  41. Efficient synthesis of promising antidiabetic triazinoindole analogues via a solvent-free method: investigating the reaction of 1,3-diketones and 2,5-dihydro-3H-[1,2,4]triazino[5,6-b]indole-3-thione
  42. Multicomponent catalyst-free regioselective synthesis and binding studies of 3-aroyl-2-methylimidazo[1,2-a]pyrimidines with BSA using biophysical and computational techniques
  43. Applications of Predictive Modeling for Various Properties of Ionic Liquids
  44. Dysprosium( iii ) complexes as potential near-white light emitters: a comprehensive study on the influence of coordination environment
  45. Highly emissive dinuclear europium( iii ) complex with heteroaryl β-diketone and fluxidentate pyrazine: dual role as UV converters and semiconductors
  46. Pyrazine-driven dinuclear assembly of dysprosium( iii ) β-diketonate complex: a fluxidentate bridging approach toward functional near-white luminescent materials
  47. Multicomponent Synthesis of 2,4,5-Trisubstituted Thiazoles Using a Sustainable Carbonaceous Catalyst and Assessment of Its Herbicidal and Antibacterial Potential
  48. Quinoxaline-linked N-acyl hydrazine: A “turn-off” fluorescent probe for the selective recognition of Fe3+ in real water samples
  49. Synthesis and photoluminescent studies of orange–red emissive samarium(III) complexes with 1,1,1-trifluoro-5,5-dimethyl-2,4-hexanedione and 2,2′-bipyridine and its distinctive analogous
  50. In silico aquatic toxicity prediction of chemicals toward Daphnia magna and fathead minnow using Monte Carlo approaches
  51. Synthesis and comprehensive analysis of luminescent dysprosium (III) complexes: Photoluminescence, thermal behavior and electrochemical properties
  52. Naphthoquinone fused diazepines targeting hyperamylasemia: potential therapeutic agents for diabetes and cancer
  53. Design and spectroscopic study of samarium complexes with tunable photoluminescent properties
  54. NUV-excitation Dy(III) complexes: Synthesis, structural study and impact of secondary ligands on optoelectronic properties
  55. Near ultra-violet excitable Tb(III)-tris-hexafluoro-2,4-pentanedione complexes for OLEDs: Insights into the impact of ancillary ligands on photoluminescent characteristics
  56. Design and photophysical characterization of dinuclear lanthanide complexes incorporating spacer ligands along with their mononuclear analogues: A comparative study
  57. Structural attributes driving λmax towards NIR region: A QSPR approach
  58. Synthesis of thiazolidine-2,4-dione tethered 1,2,3-triazoles as α-amylase inhibitors: In vitro approach coupled with QSAR, molecular docking, molecular dynamics and ADMET studies
  59. Adsorption Studies of Imidacloprid from Aqueous Solution using Polyacrylamide Coated Magnetite Nanoparticles as a Potential Nanoadsorbent
  60. Rationally designed dual channel reversible probe for cyanide recognition in aqueous medium with solid-state sensing abilities
  61. Multicellular target QSAR models for predicting of novel inhibitors against pancreatic cancer by Monte Carlo approach
  62. Mechanical, thermal and biodegradation studies of highly degradable composite films of pectin/guar gum/ polyvinylpyrrolidone with rice crop residues: a future vision of packaging and mulch films
  63. Computational and optoelectronic investigations of red-emissive europium (III) β-diketonate with n-donor ligands for display applications
  64. Photophysical analysis and Judd–Ofelt calculation of Eu (III) complexes: Influence of various neutral ligands on luminescent properties
  65. Synthesis, characterization and luminescent properties of N-donor based samarium-tris-β-diketonate: Tuning optoelectronic characteristics for displays applications
  66. Exploring the role of neutral ligands in modulating the photoluminescence of samarium complexes with 1,1,1,5,5,5‐hexafluoro‐2,4‐pentanedione
  67. Green emissive Tb(III) complexes based on photosensitizing antenna: Synthesis and optoelectronic analysis
  68. Monometallic heteroleptic complexes of Dy(III) ion incorporating β-diketone and ancillary moieties: Photophysical and electrochemical analyses
  69. Photoluminescence tuning of terbium tris-1,1,1-trifluoro-5,5-dimethyl-2,4-hexanedione complexes: Synthesis, spectroscopic, thermal and electrochemical analyses
  70. Comprehensive investigation of ternary dysprosium complexes for white light emission: Synthesis, spectroscopic and colorimetric analyses
  71. Pyrano[2,3-c]pyrazole fused spirooxindole-linked 1,2,3-triazoles as antioxidant agents: Exploring their utility in the development of antidiabetic drugs via inhibition of α-amylase and DPP4 activity
  72. TEMPLATE-ENGINEERED TRIVALENT IRON AND CHROMIUM CONTAINING MACROCYCLIC COMPLEXES: CHARACTERIZATION AND IN VITRO STUDIES
  73. 1,1,1-Trifluoro-5,5-dimethyl-2,4-hexanedione based ternary complexes of Eu(III): Synthesis, structural and luminescence investigations
  74. Examination of the spectroscopic characteristics of bright green emitting, octa coordinated luminescent terbium (III) complexes
  75. Enhancement in photophysical properties of octacoordinated Dy(III) complexes via energy transfer from photosensitizing ligands
  76. Optimizing hexafluoro-2,4-pentanedione based Eu(III) complexes: A comprehensive study on the synthesis, spectroscopic characterization with Judd-Ofelt calculation
  77. Precisely designed NIR based conjugated framework as a solid state emitter for selective recognition of cyanide ion in solid state and cancer cells
  78. Preparation, characterization and spectroscopic analyses of Dy(III) β-diketonates with bidentate N donor neutral ligands for displays
  79. Rationally designed C-3 sulfenylated 2-phenyl-4H-pyrido[1,2-a]pyrimidin-4-one based fluorescent probe for recognition of Fe3+
  80. Remediation of toluidine blue O dye from aqueous solution using surface functionalized magnetite nanoparticles
  81. Samarium (III) complexes with tunable luminescence: efficient sensitization and semiconducting properties for optoelectronic devices
  82. Synthesis and photoluminescent analyses of ternary terbium(III) Tris-β-diketonate complexes: a systematic exploration
  83. Correlation intensity index-index of ideality of correlation: A hyphenated target function for furtherance of MAO-B inhibitory activity assessment
  84. Conducting polymers and carbon nanotubes in the field of environmental remediation: Sustainable developments
  85. Analysis of good and bad fingerprint for identification of NIR based optical frameworks using Monte Carlo method
  86. Divulging indolium inspired cyanide sensors: Did it win the throne?
  87. A simple and reliable QSPR model for prediction of chromatography retention indices of volatile organic compounds in peppers
  88. Developments in conducting polymer-, metal oxide-, and carbon nanotube-based composite electrode materials for supercapacitors: a review
  89. Utilization of marine and agro-waste materials as an economical and active food packaging: Antimicrobial, mechanical and biodegradation studies of O-Carboxymethyl chitosan/pectin/neem composite films
  90. Optimizing white light emission in Dy(iii) complexes: impact of energy transfer from mono and bidentate ligands on luminescence
  91. Tuning emissive color of trivalent terbium ion through environmental factors: optoelectronic insights from theoretical, spectral and computational studies
  92. α‐Amylase Inhibitors Based on Thiazolidinone Skeleton: A Promising Approach in Diabetes Management
  93. Fragments of local symmetry in a sequence of amino acids: Does one can use for QSPR/QSAR of peptides?
  94. Quinoxaline-derived “turn-off” fluorescent sensor for the selective detection of Fe3+: Synthesis, spectroscopic analysis, BSA binding and computational studies
  95. Rationally designed novel phenazine based chemosensor with real time Hg2+ sensing application
  96. Kinetics and Isotherm Investigations on the Improved Adsorption of the Antibiotic Moxifloxacin from Aqueous Solution utilizing Agar Coated Magnetite Nanoparticles
  97. CORAL: probing the structural requirements for α-amylase inhibition activity of 5-(3-arylallylidene)-2-(arylimino)thiazolidin-4-one derivatives based on QSAR with correlation intensity index, molecular docking, molecular dynamics, and ADMET studies
  98. Highly efficient green corrosion inhibitor for mild steel in sulfuric acid: Experimental and DFT approach
  99. Preparation and optical studies of octacoordinated luminescent complexes of Dy(III) derived from fluorinated β-diketone and heteroaromatic neutral ligands
  100. Preparation of Ecofriendly Viable Packaging Films Based on Pectin and Agro-Waste: Thermal and Mechanical Studies by Design of Experiments Approach
  101. Precisely designed oxazolonaphthoimidazo[1,2-a]pyridine-based sensor for the detection of Fe3+ and DCP with cell imaging application
  102. Electro-organic synthesis of C-5 sulfenylated amino uracils: Optimization and exploring topoisomerase-I based anti-cancer profile
  103. Preparation and spectral features of Dy(III) β-Diketonates with m,m′-Disubstituted N-donor aromatic auxiliary moieties for displays
  104. QSAR analysis for pyrimidine and pyridine derivatives as RIPK2 (receptor interacting protein kinase 2) inhibitors
  105. α-amylase inhibition and in silico studies of novel naphtho[2,3-d]imidazole-4,9-dione linked N-acyl hydrazones
  106. Quasi-SMILES as a basis for the development of QSPR models to predict the CO2 capture capacity of deep eutectic solvents using correlation intensity index and consensus modelling
  107. Samarium (III) complexes with fluorinated diketones and heteroaromatic auxiliary moieties: Synthesis and spectral analyses
  108. Investigation of the Photophysical Properties of Green Light-Emitting Tb(III) Complexes with 6-Fluoro-3-Formylchromone and N, N′-Donor Heterocyclic Secondary Ligands for Their Potential Applications in Optoelectronic Devices
  109. In-silico activity prediction and docking studies of some flavonol derivatives as anti-prostate cancer agents based on Monte Carlo optimization
  110. Thiazolidinedione–triazole conjugates: design, synthesis and probing of the α-amylase inhibitory potential
  111. Photoluminescent Sm(III) diketonates with 1,10-phenanthroline derivatives: electrochemical and optoelectronic study
  112. Progress and challenges in electrochemical energy storage devices: Fabrication, electrode material, and economic aspects
  113. Photophysical characteristics of Eu(III) 1,3-diketonates with substituted 1,10-phenanthroline auxiliary moieties: Experimental and theoretical approach
  114. Preparation, spectral and Judd Ofelt analyses of luminous Octa-coordinated Europium (III) complexes
  115. N-donor auxiliary ligand-based terbium (III) β-diketonates: Preparation and photophysical studies
  116. Gamma-irradiated recycled polyethylene filled with Tectona grandis (teak) leaf powder: a method for upcycling of polyethylene
  117. Quantitative structure-property relationship modeling for prediction of chromatography retention indices of volatile organic compounds in peppers based on Monte Carlo approach
  118. Design and Development of COX-II Inhibitors: Current Scenario and Future Perspective
  119. Hybrid descriptors–conjoint indices: a case study on imidazole-thiourea containing glutaminyl cyclase inhibitors for design of novel anti-Alzheimer’s candidates
  120. Parsing structural fragments of thiazolidin-4-one based α-amylase inhibitors: A combined approach employing in vitro colorimetric screening and GA-MLR based QSAR modelling supported by molecular docking, molecular dynamics simulation and ADMET studies
  121. Luminescent Tb(III) complexes with Lewis bases for displays: Synthesis and spectral investigation
  122. Luminous lanthanide diketonates: Review on synthesis and optoelectronic characterizations
  123. Quantitative structure activity relationship studies of androgen receptor binding affinity of endocrine disruptor chemicals with index of ideality of correlation, their molecular docking, molecular dynamics and ADME studies
  124. Urease Inhibition and Structure‐Activity Relationship Study of Thiazolidinone‐, Triazole‐, and Benzothiazole‐Based Heterocyclic Derivatives: A Focus Review
  125. Red emissive β-diketonate Ln(III) complexes for displays: Preparation, spectroscopic and optical investigations
  126. Design, synthesis, spectroscopic characterization, single crystal X-ray analysis, in vitro α-amylase inhibition assay, DPPH free radical evaluation and computational studies of naphtho[2,3-d]imidazole-4,9-dione appended 1,2,3-triazoles
  127. Performance-based natural rubber composites reinforced with jute fibers and nano-silica: thermal, morphological, and mechanical studies with statistical optimization
  128. QSAR study of tetrahydropteridin derivatives as polo-like kinase 1(PLK1) Inhibitors with molecular docking and dynamics study
  129. CORAL: Predictions of Quality of Rice Based on Retention Index Using a Combination of Correlation Intensity Index and Consensus Modelling
  130. Computational Methods for the Design and Development of Glutaminyl Cyclase Inhibitors in Alzheimer’s Disease
  131. Development of thiazole-appended novel hydrazones as a new class of α-amylase inhibitors with anticancer assets: an in silico and in vitro approach
  132. Electro-Organic Synthesis of C-5 Sulfenylated Amino Uracils: Optimization and Exploring Topoisomerase-I Based Anticancer Profile
  133. Optical, electrochemical and photophysical analyses of heteroleptic luminescent Ln(iii) complexes for lighting applications
  134. Prediction of second-order rate constants of the sulfate radical anion with aromatic contaminants using the Monte Carlo technique
  135. Thiazolidine-2,4-dione framework containing spiropyrrolidine-oxindole and 1,2,3-triazole scaffold: synthesis, in vitro α-amylase inhibition and in silico studies
  136. Synthesis of green emissive terbium(III) complexes for displays: Optical, electrochemical and photoluminescent analysis
  137. High-performance structural linear low-density polyethylene/Saccharum munja composite: a "design-of-experiments" approach
  138. Quantitative structure–activity relationship modeling for predication of inhibition potencies of imatinib derivatives using SMILES attributes
  139. A comprehensive review on synthesis, biological profile and photophysical studies of heterocyclic compounds derived from 2,3-diamino-1,4-naphthoquinone
  140. Unravelling the thermodynamics and binding interactions of bovine serum albumin (BSA) with thiazole based carbohydrazide: Multi-spectroscopic, DFT and molecular dynamics approach
  141. Proficient exclusion of pesticide using humic acid-modified magnetite nanoparticles from aqueous solution
  142. Synthesis, spectral, biological, and computational studies of template engineered macrocyclic metal complexes
  143. Monoamine oxidase inhibitors: A concise review with special emphasis on structure activity relationship studies
  144. CORAL: Quantitative Structure Retention Relationship (QSRR) of flavors and fragrances compounds studied on the stationary phase methyl silicone OV-101 column in gas chromatography using correlation intensity index and consensus modelling
  145. Effect of substituted 2,2′-bipyridine derivatives on luminescence characteristics of green emissive terbium complexes: Spectroscopic and optical analysis
  146. Mononuclear luminous β‐diketonate Ln(III) complexes with heteroaromatic auxiliary ligands: synthesis and luminescence characteristics
  147. Identifications of good and bad structural fragments of hydrazone/2,5-disubstituted-1,3,4-oxadiazole hybrids with correlation intensity index and consensus modelling using Monte Carlo based QSAR studies, their molecular docking and ADME analysis
  148. Dye Elimination by Surface-Functionalized Magnetite Nanoparticles: Kinetic and Isotherm Studies
  149. Development of reliable quantitative structure–toxicity relationship models for toxicity prediction of benzene derivatives using semiempirical descriptors
  150. Luminous terbium and samarium complexes with diacetylmethane and substituted 1,10-phenanthroline derivatives for display applications: Preparation and optoelectronic investigations
  151. Influence of coordinating environment on photophysical properties of UV excited sharp red emitting material: Judd Ofelt analysis
  152. Red luminous Eu(III) complexes: Preparation, spectral, optical and theoretical evaluation
  153. Preparation, spectroscopic and thermal investigation of fluorinated Sm(III) β-diketonates with bidentate N donor ligands
  154. CORAL: Development of a hybrid descriptor based QSTR model to predict the toxicity of dioxins and dioxin-like compounds with correlation intensity index and consensus modelling
  155. QSRR modelling for the investigation of gas chromatography retention indices of flavour and fragrance compounds on Carbowax 20 ​M glass capillary column with the index of ideality of correlation and the consensus modelling
  156. Preparation and optical investigation of green luminescent ternary terbium complexes with aromatic β-diketone
  157. Creation of Quantitative Feature Toxicity Relationship Models for Cytotoxicity of Cadmium Containing Quantum Dots Towards HEK Cells Using QuasiSMILES
  158. Sonochemical Protocols for Heterocyclic Synthesis: A Representative Review
  159. A sustainable approach to the development of highly degradable packaging films of pectin/guar gum/polyvinyl pyrrolidone: Thermal, biodegradation, and mechanical studies with statistical optimization
  160. Monte Carlo based QSGFEAR: prediction of Gibb's free energy of activation at different temperatures using SMILES based descriptors
  161. Ecotoxicological prediction of organic chemicals toward Pseudokirchneriella subcapitata by Monte Carlo approach
  162. Correction: Ecotoxicological prediction of organic chemicals toward Pseudokirchneriella subcapitata by Monte Carlo approach
  163. Study of Isotherm and Kinetic Parameters for Efficient Adsorption of Methylene Blue Dye onto the Surface of Meldrum’s Acid Modified SPIONs
  164. Synthesis and exploration of configurational dynamics in equilibratingE/Z2-aryliminothiazolidin-4-ones using NMR and estimation of thermodynamic parameters
  165. Bicyclic 5-5 Systems With One Bridgehead (Ring Junction) Nitrogen Atom: Three Extra Heteroatoms 3:0
  166. Quantitative structure–toxicity relationship models for predication of toxicity of ionic liquids toward leukemia rat cell line IPC-81 based on index of ideality of correlation
  167. CORAL: Monte Carlo based global QSAR modelling of Bruton tyrosine kinase inhibitors using hybrid descriptors
  168. Correlation intensity index (CII) as a benchmark of predictive potential: Construction of quantitative structure activity relationship models for anti-influenza single-stranded DNA aptamers using Monte Carlo optimization
  169. Exploring biological efficacy of novel benzothiazole linked 2,5-disubstituted-1,3,4-oxadiazole hybrids as efficient α-amylase inhibitors: Synthesis, characterization, inhibition, molecular docking, molecular dynamics and Monte Carlo based QSAR studies
  170. Unswerving modeling of hepatotoxicity of cadmium containing quantum dots using amalgamation of quasiSMILES, index of ideality of correlation, and consensus modeling
  171. Prediction of power conversion efficiency of phenothiazine-based dye-sensitized solar cells using Monte Carlo method with index of ideality of correlation
  172. A hybrid descriptor based QSPR model to predict the thermal decomposition temperature of imidazolium ionic liquids using Monte Carlo approach
  173. Solid‐Supported Materials‐Based Synthesis of 2‐Substituted Benzothiazoles: Recent Developments and Sanguine Future
  174. Synthesis, Crystal structure and DFT studies of Polyfunctionalized Alkenes: A transition Metal-Free C(sp2)-H Sulfenylation of electron deficient Alkyne
  175. A BRIEF AND SPECIFIC REVIEW ON THE UTILITY OF SURFACE FUNCTIONALIZED MAGNETITE NANOPARTICLES FOR THE REMOVAL OF DYE FROM CONTAMINATED WATER
  176. Alginate and Gum Arabic Coated Iron Oxide Nanoparticles as an Efficient Drug Carrier Agent
  177. Comparative Studies of Dye Removal Efficiency of Surface Functionalized Nanoparticles with Other Adsorbents: Isotherm and Kinetic Study
  178. Cytotoxicity of quantum dots: Use of quasiSMILES in development of reliable models with index of ideality of correlation and the consensus modelling
  179. Kinetic and Thermal Studies of Adsorption of Allura Red Dye by Surface Functionalized Magnetite Nanoparticles
  180. TEMPLATE DIRECTED SYNTHESIS AND CHARACTERIZATION OF MACROCYCLIC COMPLEXES: In-silico DOCKING AND ANTIMICROBIAL STUDIES
  181. The Monte Carlo approach to model and predict the melting point of imidazolium ionic liquids using hybrid optimal descriptors
  182. Quantitative structure activity relationship studies of novel hydrazone derivatives as α-amylase inhibitors with index of ideality of correlation
  183. Tankyrase inhibitors: emerging and promising therapeutics for cancer treatment
  184. A Monte Carlo method based QSPR model for prediction of reaction rate constants of hydrated electrons with organic contaminants
  185. Quantitative structure toxicity analysis of ionic liquids toward acetylcholinesterase enzyme using novel QSTR models with index of ideality of correlation and correlation contradiction index
  186. Computational Studies on Acetylcholinesterase Inhibitors: From Biochemistry to Chemistry
  187. Identification of good and bad fragments of tricyclic triazinone analogues as potential PKC-θ inhibitors through SMILES–based QSAR and molecular docking
  188. In silico enhancement of azo dye adsorption affinity for cellulose fibre through mechanistic interpretation under guidance of QSPR models using Monte Carlo method with index of ideality correlation
  189. In silico exploration of the fingerprints triggering modulation of glutaminyl cyclase inhibition for the treatment of Alzheimer’s disease using SMILES based attributes in Monte Carlo optimization
  190. A review of antimalarial activity of two or three nitrogen atoms containing heterocyclic compounds
  191. Construction of pioneering quantitative structure activity relationship screening models for abuse potential of designer drugs using index of ideality of correlation in monte carlo optimization
  192. Synthesis and characterization of water-soluble chitosan derivatives: spectral, thermal and biological studies
  193. In-silico identification of fingerprint of pyrazolyl sulfonamide responsible for inhibition of N-myristoyltransferase using Monte Carlo method with index of ideality of correlation
  194. Index of ideality of correlation and correlation contradiction index: a confluent perusal on acetylcholinesterase inhibitors
  195. Hydroxyenone Derivatives: In vitro Anti-malarial and Docking Studies against P. falciparum
  196. CORAL: QSAR models of CB1 cannabinoid receptor inhibitors based on local and global SMILES attributes with the index of ideality of correlation and the correlation contradiction index
  197. Use of Graph Based Descriptors for Determination of Structural Features Causing Modulation of Fructose-1,6-Bisphosphatase
  198. SURFACE MODIFIED MAGNETITE NANOPARTICLES: AN EFFECTIVE TOOL FOR THE SEPARATION OF TOXIC METAL IONS AND ORGANIC CONTAMINANTS FROM WASTEWATER
  199. Thiazolidine‐4‐one clubbed pyrazoles hybrids: Potent α‐amylase and α‐glucosidase inhibitors with NLO properties
  200. Synthesis, molecular docking and QSAR study of thiazole clubbed pyrazole hybrid as α-amylase inhibitor
  201. The index of ideality of correlation: A statistical yardstick for better QSAR modeling of glucokinase activators
  202. A Serendipitous Synthesis: SiO2‐HNO3 Mediated Oxidative Aromatization and Regioselective Nitration of 1,3,5‐Trisubstituted‐4,5‐Dihydro‐1H‐Pyrazoles
  203. Nucleobase sequence based building up of reliable QSAR models with the index of ideality correlation using Monte Carlo method
  204. In silico design of diacylglycerol acyltransferase-1 (DGAT1) inhibitors based on SMILES descriptors using Monte-Carlo method
  205. Development of prediction model for fructose- 1,6- bisphosphatase inhibitors using the Monte Carlo method
  206. Design and development of novel focal adhesion kinase (FAK) inhibitors using Monte Carlo method with index of ideality of correlation to validate QSAR
  207. Silica-supported ceric ammonium nitrate (CAN): a simple, mild and solid-supported reagent for quickest oxidative aromatization of Hantzsch 1,4-dihydropyridines
  208. QSAR Models for Nitrogen Containing Monophosphonate and Bisphosphonate Derivatives as Human Farnesyl Pyrophosphate Synthase Inhibitors Based on Monte Carlo Method
  209. CAN Mediated Mechanochemical Synthesis of Substituted Pyridine Derivatives
  210. Thermal and biological studies of Schiff bases of chitosan derived from heteroaryl aldehydes
  211. Correction to: Design, synthesis, conformational and molecular docking study of some novel acyl hydrazone based molecular hybrids as antimalarial and antimicrobial agents
  212. Design, synthesis, conformational and molecular docking study of some novel acyl hydrazone based molecular hybrids as antimalarial and antimicrobial agents
  213. Monte Carlo Method Based QSAR Studies of Mer Kinase Inhibitors in Compliance with OECD Principles
  214. Multicomponent Synthesis of Some Molecular Hybrid Containing Thiazole Pyrazole as Apoptosis Inducer
  215. Synthesis of some benzothiazoles by developing a new protocol using urea nitrate as a catalyst and their antimicrobial activities
  216. Synthesis of Some 4-Quinolinyl Pyridines and their Antimicrobial and Docking Studies
  217. A green and convenient synthesis of 2-aroylbenzofurans in aqueous media
  218. Photo-reorganization of 3-alkoxy-6-chloro-2-(benzo[b ]thiophen-2-yl)-4H-chromen-4-ones: a green and convenient synthesis of angular pentacyclics
  219. Synthesis of novel inhibitors of α-amylase based on the thiazolidine-4-one skeleton containing a pyrazole moiety and their configurational studies
  220. Estrogenic and Anti-Alzheimer’s studies of Zingiber officinalis as well as Amomum subulatum Roxb.: the success story of dry techniques
  221. An economic, simple and convenient synthesis of 2-aryl/heteroaryl/styryl/alkylbenzothiazoles using SiO2–HNO3
  222. ChemInform Abstract: Intramolecular Cyclization of Photolabile Thienylchromenones (I): Synthesis of Angular Tetracyclic Compounds (II).
  223. Synthesis and Evaluation of Bioactivity of Thiazolo[3,2‐b]‐[1,2,4]‐triazoles and Isomeric Thiazolo[2,3‐c]‐[1,2,4]‐triazoles
  224. ChemInform Abstract: Solvent-Free One Pot Synthesis of 2-Aryl/Heteroarylbenzothiazoles Using Hypervalent Iodine(III) Reagents.
  225. Hypervalent Iodine Mediated Oxidative Cyclization of Arenecarbaldehyde-1,3-Benzothiazol-2-yl Hydrazones: An Efficient Synthesis of 3-Aryl-1,2,4-Triazolo[3,4-b]-1,3-Benzothiazoles
  226. Study of binding of pyridoacridine alkaloids on topoisomerase II using in silico tools
  227. Solvent-Free One Pot Synthesis of 2-aryl/Heteroarylbenzothiazoles Using Hypervalent Iodine (III) Reagents
  228. Iodobenzene diacetate (IBD) catalyzed an quick oxidative aromatization of Hantzsch-1,4-dihydropyridines to pyridines under ultrasonic irradiation
  229. Synthesis and antimicrobial activity of some (3-phenyl-5-(1-phenyl-3-aryl-1H-pyrazol-4-yl)-4,5-dihydro-1H-pyrazol-1-yl)(pyridin-4-yl)methanones: new derivatives of 1,3,5-trisubstituted pyrazolines
  230. An environmentally benign and solvent-free synthesis of 3-aryl[1,2,4]triazolo[4,3-a]pyridines and 1-aryl-5-methyl[1,2,4]triazolo[4,3-a]quinolines using phenyliodine bis(trifluoroacetate) or iodobenzene diacetate
  231. ChemInform Abstract: An Efficient Synthesis of Pyrazole Chalcones under Solvent‐Free Conditions at Room Temperature.
  232. ChemInform Abstract: A Novel, Facile, Simple and Convenient Oxidative Aromatization of Hantzsch 1,4‐Dihydropyridines to Pyridines Using Polymeric Iodosobenzene with KBr.
  233. ChemInform Abstract: An Expeditious Synthesis of Isoxazoline Using Cetyltrimethylammonium Cerium Nitrate: A Phase Transferring Oxidative 1,3‐Dipolar Cycloaddition.
  234. An efficient synthesis of pyrazole chalcones under solvent free conditions at room temperature
  235. ChemInform Abstract: An Expeditious Oxidative Aromatization of Hantzsch 1,4‐Dihydropyridines to Pyridines Using Cetyltrimethylammonium Peroxodisulfate: A Phase Transferring Oxidant.
  236. Heterocyclic Systems Containing Bridgehead Nitrogen Atom:Synthesis and Evaluation of Biological Activity of Imidazo[2,1-b]-1,3,4-thiadiazolo [2,3-c]-s-triazoles, s-Triazolo[3,4-b]-1,3,4-thiadiazolo[3,2-b]imidazo[4,5-b]quinoxaline and bis-(s-Triazolo[3,...
  237. An expeditious synthesis of isoxazoline using cetyltrimethylammonium cerium nitrate: A phase transferring oxidative 1,3-dipolar cycloaddition
  238. A novel, facile, simple and convenient oxidative aromatization of Hantzsch 1,4‐dihydropyridines to pyridines using polymeric iodosobenzene with KBr
  239. An Expeditious Oxidative Aromatization of Hantzsch 1,4-Dihydropyridines to Pyridines Using Cetyltrimethylammonium Peroxodisulfate: A Phase Transferring Oxidant
  240. 3-Aryl-2-{4-[4-(2,4-dioxothiazolidin-5-ylmethyl)phenoxy]-phenyl}-acrylic acid alkyl ester: synthesis and antihyperglycemic evaluation
  241. Synthesis and Pharmacological Evaluation of Some Novel Imidazo[2,1‐b][1,3,4]thiadiazole Derivatives
  242. ChemInform Abstract: Solid State Oxidative Aromatization of Hantzsch 1,4‐Dihydropyridines to Pyridines Using Iodobenzene Diacetate or Hydroxy(tosyloxy)iodobenzene.
  243. Solid State Oxidative Aromatization of Hantzsch 1,4‐Dihydropyridines to Pyridines Using Iodobenzene Diacetate or Hydroxy(tosyloxy)iodobenzene