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Work: Avogadro: an advanced semantic chemical editor, visualization, and analysis platform

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Works citing this work

Synthesis of the Three Mixed-ligand Metal Complexes and One Organic Salt of 3,5-Dinitrobenzoic Acid for Biopharmaceutical Optimization Through Monoethanolamine: Structures and DFT Studies of Complexes

Molecular Isomerization in n-Propanol Dimers

Synthesis, structure, Hirshfeld surface analysis of the new copper complex of 3,5-dinitrobenzoic acid and docking study of its metal complexes bioactivity

Crystal structure, Hirshfeld surface analysis and DFT studies of tetrakis(μ-3-nitrobenzoato-κ<sup>2</sup> <i>O</i> <sup>1</sup>:<i>O</i> <sup>1′</sup>)bis[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)copper(II)] dimethylformamide disolvate

Naja naja oxiana Cobra Venom Cytotoxins CTI and CTII Disrupt Mitochondrial Membrane Integrity: Implications for Basic Three-Fingered Cytotoxins

Euphorbia prostrata as an eco-friendly corrosion inhibitor for steel: electrochemical and DFT studies

Quantum chemical calculation of piperidine-based synthesized compounds using the PM-3 semiempirical method

Electrochemical and DFT Studies of the <i>Pistacia Integerrima</i> Gall Extract: An Eco-friendly Approach towards the Corrosion of Steel in Acidic Medium

Antimicrobial activity enhancement and acute toxicity lowering of benzamide through preparation of metal complexes

Synthesis, structure, Hirshfeld surface analysis, and molecular docking studies of the cocrystal between the Cu(II) complex of salicylic acid and uncoordinated piracetam

Synthesis, Crystal structure, Hirshfeld surface, Thermal analysis and DFT Calculations of Zn(II) complex of mixed ligand from 2,4-dichlorophenoxy acid (2, 4-D) and ethylenediamine (en)

Bioactivity profiling of <i>Sanghuangporus lonicerinus</i> : antioxidant, hypoglycaemic, and anticancer potential via <i>in-vitro</i> and <i>in-silico</i> approaches

Synthesis, Structure, and Properties of Acetoacetanilide Acetylhydrazone

Effect of nanoparticle size on the thermal performance of paraffin-O2 hybrid heat sink using molecular dynamics approach

A new polymorphic form of 3b,11a,14-trihydroxy-5b,14b-bufa-20,22-dienolide (telocinobufagin) and its p300 and NNMT inhibitory activity

Problems of Visualization and 3d Modeling in Chemistry: Analysis of Electronodonor Properties and Spatial Complex-Forming Structure of the Obtained Sulfocationite

Structural characterization of benzketozone monohydrate

Synthesis, crystal structure, Hirshfeld surface analysis and DFT study of the 1,1′-(buta-1,3-diyne-1,4-diyl)bis(cyclohexan-1-ol)

Synthesis, Structure, DFT and In Silico Studies of Zn (II) Complex with Lipoic Acid: A Potential Antidiabetic Drug

Antimicrobial Activity Enhancement and Acute Toxicity Lowering of Benzamide Through Preparation of Metal Complexes

Identification of the myxobacterial secondary metabolites Aurachin A and Soraphinol A as promising inhibitors of thymidylate kinase of the Monkeypox virus

Synergistic mixture of the Dactyloctenium aegyptium extract and KI as an environment friendly and highly efficient corrosion inhibitor for steel in 0.5 M HCl

Examination of the mechanical properties of porous carbon matrix by considering the Nanovoids: A computational study using molecular dynamics simulation

Modeling the influence of external heat flux on thermal characteristics of the silica aerogel/paraffin in a cylindrical atomic duct

Investigating the effect of copper oxide nanoparticles radius on thermal behavior of silica aerogel/paraffin nanostructure using molecular dynamics simulation