DFT-based inhibitor and promoter selection criteria for pentagonal dodecahedron methane hydrate cage.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1259, doi. 10.1007/s12039-013-0470-2
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- Publication type:
- Article
Works matching IS 09743626 AND DT 2013 AND VI 125 AND IP 5
Results: 38
1
2
Organocatalysis for the synthesis of optically active β-malonophosphonates.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1109, doi. 10.1007/s12039-013-0487-6
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- Article
3
Contents.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 959, doi. 10.1007/s12039-013-0521-8
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- Article
4
Synthesis, characterization and catalytic activity of sulphonated multi-walled carbon nanotubes as heterogeneous, robust and reusable catalysts for the synthesis of bisphenolic antioxidants under solvent-free conditions.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1185, doi. 10.1007/s12039-013-0476-9
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- Publication type:
- Article
5
Green and solvent-free procedure for microwave-assisted synthesis of 2,4,6-triarylpyridines catalysed using MgAlO nanocrystals.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1063, doi. 10.1007/s12039-013-0477-8
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- Publication type:
- Article
6
Role of substituents on the reactivity and electron density profile of diimine ligands: A density functional theory based study.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1247, doi. 10.1007/s12039-013-0469-8
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- Publication type:
- Article
7
Aza-Morita-Baylis-Hillman reaction of maleimides with azodicarboxylates under neat conditions.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 967, doi. 10.1007/s12039-013-0454-2
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- Publication type:
- Article
8
Silver iodide nanoparticle as an efficient and reusable catalyst for the one-pot synthesis of benzofurans under aqueous conditions.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1003, doi. 10.1007/s12039-013-0451-5
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- Article
9
Influence of binder solvent on carbon-layer structure in electrical-double-layer capacitors.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1177, doi. 10.1007/s12039-013-0494-7
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- Article
10
Non-adiabatic rotational excitation of dipolar molecule under the influence of delayed pulses.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1213, doi. 10.1007/s12039-013-0430-x
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- Publication type:
- Article
11
Oxidation of hydrogen peroxide by [Ni(cyclam)] in aqueous acidic media.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1123, doi. 10.1007/s12039-013-0437-3
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- Publication type:
- Article
12
Lewis acidic (choline chloride.3ZnCl) ionic liquid: A green and recyclable catalyst for the one-pot synthesis of 4-((3-indolyl)(aryl)methyl)-N,N-dimethylanilines under solvent-free conditions.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1009, doi. 10.1007/s12039-013-0474-y
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- Publication type:
- Article
13
Antiplasmodial and larvicidal compounds of Toddalia asiatica root bark.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1115, doi. 10.1007/s12039-013-0483-x
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- Publication type:
- Article
14
Nano n-propylsulphonated γ-FeO: A novel magnetically recyclable heterogeneous catalyst for the efficient synthesis of bis(pyrazolyl)methanes in water.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 975, doi. 10.1007/s12039-013-0481-z
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- Publication type:
- Article
15
Mechanism of electron transfer reaction of ternary dipicolinatochromium(III) complex involving oxalate as secondary ligand.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1151, doi. 10.1007/s12039-013-0491-x
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- Article
16
Quasi-classical trajectory study of the reaction H′ + HS on a new ab initio potential energy surface HS (A″).
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1237, doi. 10.1007/s12039-013-0475-x
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- Publication type:
- Article
17
Synthesis of 2,6-diaminopyridine substituted α-oxoketene S, N-acetals: Crystal structure and hydrogen bonding interactions.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1103, doi. 10.1007/s12039-013-0488-5
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- Article
18
Ultrasonic synthesis and crystal structure analysis of two trimethylsilyloxy-substituted bicyclo[2.2.2]octene derivatives.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1079, doi. 10.1007/s12039-013-0480-0
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- Publication type:
- Article
19
Methyltrioctylammonium chloride catalysed sonochemical synthesis of acridine diones.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 989, doi. 10.1007/s12039-013-0431-9
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- Publication type:
- Article
20
Growth and characterization of BCN nanotubes with high boron and nitrogen content.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1169, doi. 10.1007/s12039-013-0467-x
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- Publication type:
- Article
21
Synthesis of some novel fluoro isoxazolidine and isoxazoline derivatives using N-benzyl fluoro nitrone via cycloaddition reaction in ionic liquid.
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- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1071, doi. 10.1007/s12039-013-0495-6
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- Publication type:
- Article
22
Ionic liquid-mediated three-component synthesis of fluorinated spiro-thiazine derivatives and their antimycobacterial and DNA cleavage activities.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1045, doi. 10.1007/s12039-013-0493-8
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- Publication type:
- Article
23
Electrochemical studies of ropinirole, an anti-Parkinson's disease drug.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1197, doi. 10.1007/s12039-013-0444-4
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- Publication type:
- Article
24
DNA binding and cleavage activity by a mononuclear iron(II)Schiff base complex: Synthesis and structural characterization.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1161, doi. 10.1007/s12039-013-0473-z
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- Publication type:
- Article
25
A comparative study of independent particle model based approaches for thermal averages.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1267, doi. 10.1007/s12039-013-0484-9
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- Publication type:
- Article
26
Recyclable hydrotalcite clay catalysed Baylis-Hillman reaction.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1207, doi. 10.1007/s12039-013-0472-0
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- Publication type:
- Article
27
Photo-induced antimicrobial and DNA cleavage studies of indoloquinolines and 1,8-naphtharidine.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1015, doi. 10.1007/s12039-013-0486-7
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- Publication type:
- Article
28
TMSCl-catalysed condensation of α-diketone compounds with urea/thiourea derivatives under solvent-free conditions.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1055, doi. 10.1007/s12039-013-0471-1
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- Publication type:
- Article
29
An efficient synthesis of 3-indolyl substituted pyrido[1,2- a]benzimidazoles as potential antimicrobial and antioxidant agents.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 993, doi. 10.1007/s12039-013-0468-9
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- Publication type:
- Article
30
Montmorillonite K-10 as a catalyst in the synthesis of 5, 5-disubstituted hydantoins under ultrasound irradiation.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 981, doi. 10.1007/s12039-013-0427-5
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- Article
31
Design, synthesis and cytotoxic activity of some novel compounds containing pyrazolo[3,4- d]pyrimidines nucleus.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1029, doi. 10.1007/s12039-013-0485-8
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- Publication type:
- Article
32
Hydrolytic activity of μ-alkoxide/acetato-bridged binuclear Cu(II) complexes towards carboxylic acid ester.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1145, doi. 10.1007/s12039-013-0465-z
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- Publication type:
- Article
33
Nucleotide insertion initiated by van der Waals interaction during polymerase beta DNA replication.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1223, doi. 10.1007/s12039-013-0452-4
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- Article
34
Synthesis and evaluation of some novel precursors of oxazolidinone analogues of chloroquinoline for their antimicrobial and cytotoxic potential.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1093, doi. 10.1007/s12039-013-0492-9
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- Publication type:
- Article
35
Kinetics and mechanism of interaction of some bioactive ligands with cis-diaqua( cis-1,2-diaminocyclohexane)platinum(II) in aqueous medium.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1133, doi. 10.1007/s12039-013-0455-1
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- Publication type:
- Article
36
Ab initio study of 1:1 complexes of nitrogen trifluoride with nitrous oxide and carbon dioxide in vacuo.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1277, doi. 10.1007/s12039-013-0497-4
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- Publication type:
- Article
37
Simulating chemical systems: MPI and GPU parallelization of novel SD algorithms.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1285, doi. 10.1007/s12039-013-0490-y
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- Publication type:
- Article
38
The reaction of carbon disulphide with α-haloketones and primary amines in the presence of potassium iodide as catalyst.
- Published in:
- Journal of Chemical Sciences, 2013, v. 125, n. 5, p. 1087, doi. 10.1007/s12039-013-0482-y
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- Publication type:
- Article