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PubPharm (76)
1
The system of self-consistent models based on quasi-SMILES as a tool to predict the potential of nano-inhibitors of human lung carcinoma cell line A549 for different experimental conditions
enthalten in:
Drug and chemical toxicology
| 2024
von
Toropova, A.
|
Meneses, J.
|
Alfaro-Moreno, E.
| +1
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2
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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3
The coefficient of conformism of a correlative prediction (CCCP) : Building up reliable nano-QSPRs/QSARs for endpoints of nanoparticles in different experimental conditions encoded via quasi-SMILES
enthalten in:
The Science of the total environment
| 2024
von
Toropova, A.
|
Toropov, A.
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4
Quasi-SMILES as a basis to build up models of endpoints for nanomaterials
enthalten in:
Environmental technology
| 2023
von
Toropova, A.
|
Toropov, A.
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5
Semi-Correlations for Building Up a Simulation of Eye Irritation
enthalten in:
Toxics
| 2023
von
Toropov, A.
|
Toropova, A.
|
Roncaglioni, A.
| +1
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6
The System of Self-Consistent Models : The Case of Henry's Law Constants
enthalten in:
Molecules (Basel, Switzerland)
| 2023
von
Toropov, A.
|
Toropova, A.
|
Roncaglioni, A.
| +3
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7
Using the local symmetry in amino acids sequences of polypeptides to improve the predictive potential of models of their inhibitor activity
enthalten in:
Amino acids
| 2023
von
Toropova, A.
|
Toropov, A.
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8
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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9
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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10
Cheminformatics and Machine Learning Approaches to Assess Aquatic Toxicity Profiles of Fullerene Derivatives
enthalten in:
International journal of molecular sciences
| 2023
von
Fjodorova, N.
|
Novič, M.
|
Venko, K.
| +6
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Medienart: E-Artikel
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Erscheinungsjahr: 2020-2029
Medienart
76
Aufsätze
E-Artikel
76
E-Ressourcen
Zeitschriftentitel
10
Structural chemistry
6
The Science of the total environment
4
Toxicology mechanisms and methods
3
Archives of environmental contamination and tox...
3
International journal of molecular sciences
3
Molecular diversity
3
Molecules (Basel, Switzerland)
3
Theoretical chemistry accounts
3
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2
Combinatorial chemistry & high throughput scree...
2
Computers in biology and medicine
2
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2
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2
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2
Journal of biomolecular structure & dynamics
2
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2
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2
ResearchSquare.com
1
Amino acids
1
Aquatic toxicology (Amsterdam, Netherlands)
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Thema
54
Journal Article
45
Monte Carlo method
35
CORAL software
29
QSAR
14
Index of ideality of correlation
12
Research Support, Non-U.S. Gov't
8
QSPR
7
SMILES
7
index of ideality of correlation
6
Quasi-SMILES
5
Oxides
5
Pesticides
4
Correlation intensity index
4
Mutagens
4
Nano-QSAR
4
Water Pollutants, Chemical
4
correlation intensity index
4
quasi-SMILES
3
Amino acid
3
Biochemical endpoints
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Erscheinungszeitraum
2020-
3
2024
22
2023
14
2022
17
2021
20
2020
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