相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。QSAR modeling in ecotoxicological risk assessment: application to the prediction of acute contact toxicity of pesticides on bees (Apis mellifera L.)
Mabrouk Hamadache et al.
ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH (2018)
Neonicotinoids and Other Insect Nicotinic Receptor Competitive Modulators: Progress and Prospects
John E. Casida
ANNUAL REVIEW OF ENTOMOLOGY, VOL 63 (2018)
The ChEMBL database in 2017
Anna Gaulton et al.
NUCLEIC ACIDS RESEARCH (2017)
QSAR modeling for predicting mutagenic toxicity of diverse chemicals for regulatory purposes
Nikita Basant et al.
ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH (2017)
Pentachlorophenol molecule design with lower bioconcentration through 3D-QSAR associated with molecule docking
Xiaolei Wang et al.
ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH (2017)
Latest generation of halogen-containing pesticides
Peter Jeschke
PEST MANAGEMENT SCIENCE (2017)
PubChem Substance and Compound databases
Sunghwan Kim et al.
NUCLEIC ACIDS RESEARCH (2016)
An international database for pesticide risk assessments and management
Kathleen A. Lewis et al.
HUMAN AND ECOLOGICAL RISK ASSESSMENT (2016)
A Quantitative Structure Activity Relationship for acute oral toxicity of pesticides on rats: Validation, domain of application and prediction
Mabrouk Hamadache et al.
JOURNAL OF HAZARDOUS MATERIALS (2016)
On a simple approach for determining applicability domain of QSAR models
Kunal Roy et al.
CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS (2015)
Facile three-component synthesis and insecticidal evaluation of hexahydroimidazo[1,2-a]pyridine derivatives
Ye-Feng Fan et al.
CHINESE CHEMICAL LETTERS (2015)
Beware of R2: Simple, Unambiguous Assessment of the Prediction Accuracy of QSAR and QSPR Models
D. L. J. Alexander et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2015)
POSIT: Flexible Shape-Guided Docking For Pose Prediction
Brian P. Kelley et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2015)
The global status of insect resistance to neonicotinoid insecticides
Chris Bass et al.
PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY (2015)
Systemic insecticides (neonicotinoids and fipronil): trends, uses, mode of action and metabolites
N. Simon-Delso et al.
ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH (2015)
Insecticide resistance and cross-resistance development in Colorado potato beetle Leptinotarsa decemlineata Say (Coleoptera: Chrysomelidae) populations in Canada 2008-2011
Ian M. Scott et al.
PEST MANAGEMENT SCIENCE (2015)
Computational Investigations about the Effects of Heteromolecular Aggregation on Bioactivities: a Case of Neonicotinoids and Water
Shuang Xia et al.
CHINESE JOURNAL OF CHEMISTRY (2014)
Risks of neonicotinoid insecticides to honeybees
Anne Fairbrother et al.
ENVIRONMENTAL TOXICOLOGY AND CHEMISTRY (2014)
Design, Synthesis, Crystal Structure, Insecticidal Activity, Molecular Docking, and QSAR Studies of Novel N3-Substituted Imidacloprid Derivatives
Mei-Juan Wang et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2014)
Seven-Membered Azabridged Neonicotinoids: Synthesis, Crystal Structure, Insecticidal Assay, and Molecular Docking Studies
Renbo Xu et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2014)
Neuroactive Insecticides: Targets, Selectivity, Resistance, and Secondary Effects
John E. Casida et al.
ANNUAL REVIEW OF ENTOMOLOGY, VOL 58 (2013)
Synthesis and Biological Evaluation of Nitromethylene Neonicotinoids Based on the Enhanced Conjugation
Siyuan Lu et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2013)
QSARINS: A new software for the development, analysis, and validation of QSAR MLR models
Paola Gramatica et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2013)
Conformer Generation with OMEGA: Learning from the Data Set and the Analysis of Failures
Paul C. D. Hawkins et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2012)
FRED and HYBRID docking performance on standardized datasets
Mark McGann
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN (2012)
On the Use of the Metric rm2 as an Effective Tool for Validation of QSAR Models in Computational Drug Design and Predictive Toxicology
K. Roy et al.
MINI-REVIEWS IN MEDICINAL CHEMISTRY (2012)
QSAR Modeling is not Push a Button and Find a Correlation: A Case Study of Toxicity of (Benzo-)triazoles on Algae
Paola Gramatica et al.
MOLECULAR INFORMATICS (2012)
N-Haloacetylimino neonicotinoids: Potency and molecular recognition at the insect nicotinic receptor
Motohiro Tomizawa et al.
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2011)
Synthesis, Insecticidal Activity, and Molecular Docking Studies of Nitenpyram Analogues with a Flexible Ester Arm Anchored on Tetrahydropyrimidine Ring
Chuanwen Sun et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2011)
Overview of the Status and Global Strategy for Neonicotinoids
Peter Jeschke et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2011)
Real External Predictivity of QSAR Models: How To Evaluate It? Comparison of Different Validation Criteria and Proposal of Using the Concordance Correlation Coefficient
Nicola Chirico et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2011)
FRED Pose Prediction and Virtual Screening Accuracy
Mark McGann
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2011)
Impact of imidacloprid residues on the development of Eisenia fetida during vermicomposting of greenhouse plant waste
Manuel J. Fernandez-Gomez et al.
JOURNAL OF HAZARDOUS MATERIALS (2011)
Nitromethylene Neonicotinoids Analogues with Tetrahydropyrimidine Fixed cis-Configuration: Synthesis, Insecticidal Activities, and Molecular Docking Studies
Chuanwen Sun et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2010)
Design, Multicomponent Synthesis, and Bioactivities of Novel Neonicotinoid Analogues with 1,4-Dihydropyridine Scaffold
Wenwen Zhang et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2010)
ChemSpider: An Online Chemical Information Resource
Harry E. Pence et al.
JOURNAL OF CHEMICAL EDUCATION (2010)
Conformer Generation with OMEGA: Algorithm and Validation Using High Quality Structures from the Protein Databank and Cambridge Structural Database
Paul C. D. Hawkins et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2010)
Design, Synthesis, and Insecticidal Activities of Novel Analogues of Neonicotinoids: Replacement of Nitromethylene with Nitroconjugated System
Xusheng Shao et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2009)
Comments on the Definition of the Q2 Parameter for QSAR Validation
Viviana Consonni et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2009)
Diverse Actions and Target-Site Selectivity of Neonicotinoids: Structural Insights
Kazuhiko Matsuda et al.
MOLECULAR PHARMACOLOGY (2009)
On Two Novel Parameters for Validation of Predictive QSAR Models
Partha Pratim Roy et al.
MOLECULES (2009)
Is Feature Selection Essential for ANN Modeling?
Mohammad Goodarzi et al.
QSAR & COMBINATORIAL SCIENCE (2009)
cis-Nitromethylene neonicotinoids as new nicotinic family: Synthesis, structural diversity, and insecticidal evaluation of hexahydroimidazo[1,2-α]pyridine
Xusheng Shao et al.
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2008)
Crystal structures of Lymnaea stagnalis AChBP in complex with neonicotinoid insecticides imidacloprid and clothianidin
Makoto Ihara et al.
INVERTEBRATE NEUROSCIENCE (2008)
External Validation and Prediction Employing the Predictive Squared Correlation Coefficient - Test Set Activity Mean vs Training Set Activity Mean
Gerrit Schueuermann et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2008)
Insecticidal and neuroblocking potencies of variants of the thiazolidine moiety of thiacloprid and quantitative relationship study for the key neonicotinoid pharmacophore
Shinzo Kagabu et al.
JOURNAL OF PESTICIDE SCIENCE (2008)
News from the front line: reports from the Global Workshop on the Stewardship of Neonicotinoid Insecticides, Honolulu, Hawaii, 5-6 June 2008
Ralf Nauen et al.
PEST MANAGEMENT SCIENCE (2008)
Neonicotinoids - from zero to hero in insecticide chemistry
Peter Jeschke et al.
PEST MANAGEMENT SCIENCE (2008)
Principles of QSAR models validation: internal and external
Paola Gramatica
QSAR & COMBINATORIAL SCIENCE (2007)
Synthesis, insecticidal activity, and QSAR of novel nitromethylene neonicotinoids with tetrahydropyridine fixed cis configuration and exo-ring ether modification
Zhongzhen Tian et al.
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY (2007)
Robust statistics in data analysis - A review basic concepts
M. Daszykowski et al.
CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS (2007)
Comparative study of QSAR/QSPR correlations using support vector machines, radial basis function neural networks, and multiple linear regression
XJ Yao et al.
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES (2004)
Why insecticides are more toxic to insects than people: The unique toxicology of insects
JE Casida et al.
JOURNAL OF PESTICIDE SCIENCE (2004)
Use of QSARs in international decision-making frameworks to predict ecologic effects and environmental fate of chemical substances
MTD Cronin et al.
ENVIRONMENTAL HEALTH PERSPECTIVES (2003)
QSAR models using a large diverse set of estrogens
LM Shi et al.
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES (2001)
分享论文
