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/vufind/Search/Results?lookfor=%22Toropova%2C+Alla+P%22&type=Person&filter%5B%5D=topic_facet%3A%22QSAR%22
/vufind/Search/Results?lookfor=%22Toropova%2C+Alla+P%22&type=Person&filter%5B%5D=topic_facet%3A%22QSAR%22
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PubPharm (118)
1
Does the accounting of the local symmetry fragments in quasi-SMILES improve the predictive potential of the QSAR models of toxicity toward tadpoles?
enthalten in:
Toxicology mechanisms and methods
| 2024
von
Toropova, A.
|
Toropov, A.
|
Roncaglioni, A.
| +1
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2
In silico prediction of the mutagenicity of nitroaromatic compounds using correlation weights of fragments of local symmetry
enthalten in:
Mutation research. Genetic toxicology and environmental mutagenesis
| 2023
von
Toropov, A.
|
Toropova, A.
|
Roncaglioni, A.
| +1
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3
The enhancement scheme for the predictive ability of QSAR : A case of mutagenicity
enthalten in:
Toxicology in vitro : an international journal published in association with BIBRA
| 2023
von
Toropova, A.
|
Toropov, A.
|
Roncaglioni, A.
| +1
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4
The system of self-consistent models for pesticide toxicity to Daphnia magna
enthalten in:
Toxicology mechanisms and methods
| 2023
von
Toropov, A.
|
Toropova, A.
|
Roncaglioni, A.
| +1
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5
The validation of predictive potential via the system of self-consistent models : the simulation of blood-brain barrier permeation of organic compounds
enthalten in:
Journal of molecular modeling
| 2023
von
Toropova, A.
|
Toropov, A.
|
Roncaglioni, A.
| +3
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6
The validation of predictive potential via the system of self-consistent models: the simulation of blood–brain barrier permeation of organic compounds
enthalten in:
Journal of molecular modeling
| 2023
von
Toropova, A.
|
Toropov, A.
|
Roncaglioni, A.
| +3
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7
The validation of predictive potential via the system of self-consistent models: the simulation of blood–brain barrier permeation of organic compounds
enthalten in:
Journal of molecular modeling
| 2023
von
Toropova, A.
|
Toropov, A.
|
Roncaglioni, A.
| +3
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8
Development of Self-Consistency Models of Anticancer Activity of Nanoparticles under Different Experimental Conditions Using Quasi-SMILES Approach
enthalten in:
Nanomaterials (Basel, Switzerland)
| 2023
von
Toropov, A.
|
Toropova, A.
|
Leszczynska, D.
| +1
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9
Machine-learning technique, QSAR and molecular dynamics for hERG-drug interactions
enthalten in:
Journal of biomolecular structure & dynamics
| 2023
von
Das, N.
|
Sharma, T.
|
Toropov, A.
| +3
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10
The searching for agents for Alzheimer's disease treatment via the system of self-consistent models
enthalten in:
Toxicology mechanisms and methods
| 2022
von
Toropov, A.
|
Toropova, A.
|
Achary, P.
| +2
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Thema: QSAR
Medienart
118
Aufsätze
96
E-Artikel
96
E-Ressourcen
22
Gedruckte Aufsätze
Zeitschriftentitel
18
Structural chemistry
11
Molecular diversity
9
Central European journal of chemistry
6
Medicinal chemistry research
6
Toxicology mechanisms and methods
5
Environmental science and pollution research
4
Ecotoxicology and environmental safety
4
Environmental toxicology and pharmacology
4
Theoretical chemistry accounts
3
Journal of mathematical chemistry
3
Journal of molecular modeling
3
Monatshefte für Chemie
3
Toxicology letters
2
Computers in biology and medicine
2
Environmental science and pollution research in...
2
European journal of medicinal chemistry
2
Food and chemical toxicology : an international...
2
International journal of molecular sciences
2
Journal of nanoparticle research
2
Mutation research. Genetic toxicology and envir...
Alle anzeigen ...
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Thema
QSAR
70
Monte Carlo method
63
CORAL software
57
Journal Article
32
SMILES
19
Index of ideality of correlation
15
Optimal descriptor
15
Research Support, Non-U.S. Gov't
12
Toxicity
7
Index of Ideality of Correlation
7
OECD principles
6
Balance of correlation
6
Balance of correlations
6
Binding affinity
6
NOAEL
6
Organic Chemicals
6
Quasi-SMILES
6
Water Pollutants, Chemical
5
Ecology
5
Mutagens
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Erscheinungszeitraum
34
2020-
83
2010-2019
1
2000-2009
Erscheinungsjahr(e)
Von:
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Sprache
118
Englisch
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