2,905 results on '"Mehdi D"'
Search Results
52. Silicon-doped boron nitride graphyne-like sheet for catalytic N2O reduction: A DFT study
53. Y decorated all-boron B38 nanocluster for reversible molecular hydrogen storage: A first-principles investigation
54. Carbon dioxide storage and separation using all-boron B38 fullerene: DFT calculations
55. Sc-functionalized porphyrin-like porous fullerene for CO2 storage and separation: A first-principles evaluation
56. Cortinarius steglichii: a taxonomical and chemical novelty from Chile.
57. The influence of Ag+ cation on elemental sulfur passive layer and adsorption behavior of chalcopyrite toward Fe3+ and Fe2+ ions: Insights from DFT calculations and molecular dynamics simulations
58. Sc functionalized boron-rich C60 fullerene for efficient storage and separation of CO2 molecules: A DFT investigation
59. Optical and photocatalytic characteristics of Al and Cu doped TiO2: Experimental assessments and DFT calculations
60. Critical assessment of structure-based approaches to improve protein resistance in aqueous ionic liquids by enzyme-wide saturation mutagenesis
61. A DFT investigation into the possibility of using noble gas encapsulated fullerenes for Li storage
62. A DFT investigation into the effects of As-doping on the electronic structure and electrochemical activity of pyrite (FeS2)
63. Single Al atom anchored on defective MoS2: An efficient catalytic site for reduction of greenhouse N2O gas by CO or C2H4 molecules
64. Al-decorated C24N24 fullerene: A robust single-atom catalyst for CO oxidation
65. Peptide-based drug discovery through artificial intelligence: towards an autonomous design of therapeutic peptides
66. Acrylate‐derived RAFT Polymers for Enzyme Hyperactivation – Boosting the α‐Chymotrypsin Enzyme Activity Using Tailor‐Made Poly(2‐Carboxyethyl)acrylate (PCEA)
67. Y-shape structured azo dyes with self-transforming feature to zwitterionic form as sensitizer for DSSC and DFT investigation of their photophysical and charge transfer properties
68. Effects of B and N doping/codoping on the adsorption behavior of C60 fullerene towards aspirin: A DFT investigation
69. Exploring the structural and transport properties of glyceline DES-Based boron nitride nanotube Nanofluid: The effects of nanotube diameter
70. Catalytic CO oxidation reaction over N-substituted graphene nanoribbon with edge defects
71. Ca coated B40 fullerene: A promising material for CO2 storage and separation
72. Generation of phytase chimeras with low sequence identities and improved thermal stability
73. Are choline chloride-based deep eutectic solvents better than methyl diethanolamine solvents for natural gas Sweetening? theoretical insights from molecular dynamics simulations
74. DFT study and electrochemical investigation of Fe3+ion interaction on chalcopyrite (0 0 1)-S and M (M = Cu, Fe) surfaces: A thermodynamic insights
75. Highly tunable TetR-dependent target gene expression in the acetic acid bacterium Gluconobacter oxydans
76. Defect engineering-induced porosity in graphene quantum dots embedded metal-organic frameworks for enhanced benzene and toluene adsorption
77. Catalytic role of B atoms in CO oxidation on B-doped graphene
78. Molecular dynamics simulations of choline chloride and phenyl propionic acid deep eutectic solvents: Investigation of structural and dynamics properties
79. Recombination of Single Beneficial Substitutions Obtained from Protein Engineering by Computer-Assisted Recombination (CompassR)
80. NO electrochemical reduction over Si-N4 embedded graphene: A DFT investigation
81. Aqueous ionic liquids redistribute local enzyme stability via long-range perturbation pathways
82. Can constraint network analysis guide the identification phase of KnowVolution? A case study on improved thermostability of an endo-β-glucanase
83. Recombination of Compatible Substitutions by 2GenReP and InSiReP
84. Using Molecular Simulation to Guide Protein Engineering for Biocatalysis in Organic Solvents
85. Evolutionary Probability and Stacked Regressions Enable Data-Driven Protein Engineering with Minimized Experimental Effort.
86. Fe-decorated all-boron B40 fullerene serving as a potential promising active catalyst for CO oxidation: A DFT mechanistic approach
87. CuN3 doped graphene as an active electrocatalyst for oxygen reduction reaction in fuel cells: A DFT study
88. Preparation and characterization of a new waste-derived mesoporous carbon structure for ultrahigh adsorption of benzene and toluene at ambient conditions
89. Constructing a dual-mode photochromic and intrinsically electrochromic device based on organic salts prepared by acid-base neutralization of pyromellitic diimides bearing a carboxyl group with aliphatic amines
90. Development of TiO2 nanofibers based semiconducting humidity sensor: adsorption kinetics and DFT computations
91. Interpretable and explainable predictive machine learning models for data-driven protein engineering
92. Low-temperature oxidation of methane mediated by Al-doped ZnO cluster and nanowire: A first-principles investigation
93. Rhenium and Molybdenum Solvent Extraction by [A336][Cy272] Bifunctional-Ionic Liquid: Dft Studies
94. Carbon Dioxide Storage and Separation Using Ca-Decorated C48b12 Fullerene: A Dft Study
95. Oxygen Reduction Reaction Catalyzed by C2n Nanosheet Doped with a Phosphorous Atom: Insights from Dft Calculations
96. Pristine and Ti- or Al-Doped B3cn4 Nanosheets as Efficient Anodes for Mg-Ion Batteries: A Dft Study
97. Ca functionalized N-doped porphyrin-like porous C60 as an efficient material for storage of molecular hydrogen
98. Tunnel engineering for modulating the substrate preference in cytochrome P450BsβHI
99. A promising and new single-atom catalyst for CO oxidation: Si-embedded MoS2 monolayer
100. Enhanced adsorptive removal of Indigo carmine dye performance by functionalized carbon nanotubes based adsorbents from aqueous solution: equilibrium, kinetic, and DFT study
Catalog
Books, media, physical & digital resources
Discovery Service for Jio Institute Digital Library
For full access to our library's resources, please sign in.