zhokhova Nelly
zhokhova Nelly
org.chem.msu.ru üzerinde doğrulanmış e-posta adresine sahip
Başlık
Alıntı yapanlar
Alıntı yapanlar
Yıl
Fragmental descriptors with labeled atoms and their application in QSAR/QSPR studies
NI Zhokhova, II Baskin, VA Palyulin, AN Zefirov, NS Zefirov
Doklady Chemistry 417 (2), 282-284, 2007
492007
Fragmental descriptors in QSPR: flash point calculations
NI Zhokhova, II Baskin, VA Palyulin, AN Zefirov, NS Zefirov
Russian chemical bulletin 52 (9), 1885-1892, 2003
342003
Fragmental descriptors in QSPR: application to molecular polarizability calculations
NI Zhokhova, II Baskin, VA Palyulin, AN Zefirov, NS Zefirov
Russian chemical bulletin 52 (5), 1061-1065, 2003
172003
The continuous molecular fields approach to building 3D-QSAR models
II Baskin, NI Zhokhova
Journal of computer-aided molecular design 27 (5), 427-442, 2013
162013
Method of continuous molecular fields in the search for quantitative structure-activity relationships
NI Zhokhova, II Baskin, DK Bakhronov, VA Palyulin, NS Zefirov
Doklady Chemistry 429 (1), 273-276, 2009
142009
Multilevel approach to the prediction of properties of organic compounds in the framework of the QSAR/QSPR methodology
II Baskin, NI Zhokhova, VA Palyulin, AN Zefirov, NS Zefirov
Doklady Chemistry 427 (1), 172-175, 2009
112009
Fragment descriptors in QSPR: Application to magnetic susceptibility calculations
NI Zhokhova, II Baskin, VA Palyulin, AN Zefirov, NS Zefirov
Journal of Structural Chemistry 45 (4), 626-635, 2004
112004
Calculation of the enthalpy of sublimation by the QSPR method with the use of a fragment approach
NI Zhokhova, II Baskin, VA Palyulin, AN Zefirov, NS Zefirov
Russian journal of applied chemistry 76 (12), 1914-1919, 2003
112003
QSPR Approach to Calculating the Rate Constants of Homolysis of Nitro Compounds in Different Aggregation States. 1
DV Sukhachev, TS Pivina, NI Zhokhova, NS Zefirov, S Zeman
Gas State. IzV. Akad. Nauk SSSR (Bull. Acad. Sci. USSR), 1653-1656, 1995
101995
One-class approach: models for virtual screening of non-nucleoside HIV-1 reverse transcriptase inhibitors based on the concept of continuous molecular fields
PV Karpov, II Baskin, NI Zhokhova, MB Nawrozkij, AN Zefirov, ...
Russian Chemical Bulletin 60 (11), 2418-2424, 2011
92011
Method of continuous molecular fields in the one-class classification task
PV Karpov, II Baskin, NI Zhokhova, NS Zefirov
Doklady Chemistry 440 (2), 263, 2011
82011
A Study of the Affinity of Dyes for Cellulose Fiber within the Framework of a Fragment Approach in QSPR
NI Zhokhova, II Baskin, VA Palyulin, AN Zefirov, NS Zefirov
Russian journal of applied chemistry 78 (6), 1013-1017, 2005
82005
Some anomalies in melting points of binary mixtures of solid hydrocarbons
ZI Syunyaev, BP Tumanyan, NI Zhokhova
Zh. Prikl. Khim. 5, 666-669, 1984
81984
Fragment descriptors in the QSPR method: Their use for calculating the enthalpies of vaporization of organic substances
NI Zhokhova, VA Palyulin, II Baskin, AN Zefirov, NS Zefirov
Russian Journal of Physical Chemistry 81 (1), 9-12, 2007
72007
Continuous indicator fields: a novel universal type of molecular fields
GV Sitnikov, NI Zhokhova, YA Ustynyuk, A Varnek, II Baskin
Journal of computer-aided molecular design 29 (3), 233-247, 2015
52015
Fragmental descriptors in (Q) SAR: Prediction of the assignment of organic compounds to pharmacological groups using the support vector machine approach
EP Kondratovich, NI Zhokhova, II Baskin, VA Palyulin, NS Zefirov
Russian Chemical Bulletin 58 (4), 657-662, 2009
52009
Pseudofragmental descriptors based on combinations of atomic properties for prediction of physical properties of polymers in quantitative structure—property relationship studies
NI Zhokhova, II Baskin, AN Zefirov, VA Palyulin, NS Zefirov
Doklady Chemistry 430 (2), 39-42, 2010
42010
Calculation of the stability of β-cyclodextrin complexes of organic compounds using the QSPR approach
NI Zhokhova, EV Bobkov, II Baskin, VA Palyulin, AN Zefirov, NS Zefirov
Moscow University Chemistry Bulletin 62 (5), 269-272, 2007
42007
QSPR approach to the calculation of rate constants of homolysis of nitro compounds in different states of aggregation
DV Sukhachev, TS Pivina, NI Zhokhova, NS Zefirov, S Zeman
Russian chemical bulletin 44 (9), 1594-1597, 1995
41995
Predictive Models for HOMO and LUMO Energies of N‐Donor Heterocycles as Ligands for Lanthanides Separation
VP Solov'ev, YA Ustynyuk, NI Zhokhova, KV Karpov
Molecular informatics 37 (11), 1800025, 2018
22018
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