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Salaev M.A., Salaeva A.A., Poleschuk O.Kh.,
Vodyankina O.V.
Re- and Cs-copromoted silver catalysts
for ethylene epoxidation:
A theoretical study
Keywords: ethylene epoxidation, silver, rhenium, cesium, DFT
Tandon H., Chakraborty T., Suhag V.
A new scale of the electrophilicity index invoking
the force concept and its application in computing
the internuclear bond distances
Keywords: electrophilicity index, effective nuclear charge,
absolute radii, periodicity, electrophilicity equalization principle,
internuclear bond distance
Mohammadnezhad G., Abad S.,
Farrokhpour H.
Theoretical evaluation of one-pot synthesis
of aliphatic PNP pincer ligands
Keywords: aliphatic PNP, pincer, SN2, kinetics,
thermodynamics
2019
1806
1797
1785
1775
1765
- 12
11, 2019
Стр.2
Fereidoni S., Ghiasi R., Pasdar H., Mohtat B.
Substituent effect on the acidity strength
of para-C6H4XB(OH)2 boronic acid:
A theoretical investigation
Keywords: boronic acid, pKa, substituent effect,
conductor-like polarized continuum model (CPCM),
atomic polar tensors (APT),
quantum theory of atoms in molecules (QTAIM)
.., ..
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: L-, , 13 -, ,
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Стр.3
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Shoukry A., Al-Fulaij O., Marzouk M., Aman N.
Structure and biological activity
of trichlorophenyl-thiosemicarbazone
and its complexes with some transition metal cations
Keywords: thiosemicarbazone, coordination compounds,
structure, biological activity
-
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,
: , ,
, , in silico,
QSAR, Microcosm BioS, ,
1901
1892
1886
1878
1873
Стр.4
Khan M. S., Khalid M., Ahmad M.S., Shahid M.,
Ahmad M.
Design and characterization of a Cu(II)
coordination polymer based on h-diimine:
Evaluation of the biomimetic activity
Keywords: Cu(II) coordination polymer, crystal structure,
catecholase activity
Liang J., Yue W., Sun Z., Tong A.
Two novel Ca(II)-carboxylate coordination polymers:
Crystal structures and antimyeloma activity evaluation
Keywords: Ca(II) coordination polymer, single crystal,
nanoparticles, myeloma, MTT assay
Xin X.-T., Wang X.-K.
Synthesis, crystal structures of two novel metal
coordination polymers and study of their inhibition
of human hemangioma cells
Keywords: coordination polymer, single crystal, hemangioma
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http://www.niic.nsc.ru/institute/conferences-inx/826-conferences-2020/3037-kuznetsovskie-chteniya-2020
© , 2019
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©
, 2019
Стр.5