SAR and QSAR in Environmental Research, Volume 22, Issue 3-4 (2011)

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SAR and QSAR in Environmental Research, Volume 22, Issue 3-4 (2011)

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Original Articles

Article
Quantitative bioactivity prediction and pharmacophore identification for benzotriazine derivatives using the electron conformational–genetic algorithm in QSAR
K. Şahin, E. Sarıpınar, E. Yanmaz & N. Geçen
Pages: 217-238
Published online: 09 Mar 2011
AbstractforQuantitative bioactivity prediction and pharmacophore identification for benzotriazine derivatives using the electron conformational–genetic algorithm in QSAR | Full Text | References | PDF (1.8 MB)
  • 180 Views
  • 13 CrossRef citations
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Article
Pharmacophore modelling, molecular docking and virtual screening for EGFR (HER 1) tyrosine kinase inhibitors
A.K. Gupta, S.S. Bhunia, V.M. Balaramnavar & A.K. Saxena
Pages: 239-263
Published online: 10 Mar 2011
AbstractforPharmacophore modelling, molecular docking and virtual screening for EGFR (HER 1) tyrosine kinase inhibitors | Full Text | References | PDF (2.5 MB)
  • 733 Views
  • 38 CrossRef citations
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Article
Androgen receptor binding affinity: a QSAR evaluation
M. Todorov, E. Mombelli, S. Aït-Aïssa & O. Mekenyan
Pages: 265-291
Published online: 18 May 2011
AbstractforAndrogen receptor binding affinity: a QSAR evaluation | Full Text | References | PDF (1 MB)
  • 316 Views
  • 17 CrossRef citations
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Article
QSAR modelling of integrin antagonists using enhanced Bayesian regularised genetic neural networks
M. Jalali-Heravi & A. Mani-Varnosfaderani
Pages: 293-314
Published online: 18 May 2011
AbstractforQSAR modelling of integrin antagonists using enhanced Bayesian regularised genetic neural networks | Full Text | References | PDF (773.2 KB)
  • 130 Views
  • 10 CrossRef citations
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Article
Using molecular docking to investigate the anti-breast cancer activity of low molecular weight compounds present on wild mushrooms
H.J.C. Froufe, R.M.V. Abreu & I.C.F.R. Ferreira
Pages: 315-328
Published online: 18 May 2011
AbstractforUsing molecular docking to investigate the anti-breast cancer activity of low molecular weight compounds present on wild mushrooms | Full Text | References | PDF (899.3 KB)
  • 362 Views
  • 5 CrossRef citations
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Article
Does the oestrogen receptor encourage oestrogenicity in environmental pollutants? The case of 4-nonylphenol
L.A. Graham & I.C. Shaw
Pages: 329-350
Published online: 18 May 2011
AbstractforDoes the oestrogen receptor encourage oestrogenicity in environmental pollutants? The case of 4-nonylphenol | Full Text | References | PDF (825.4 KB)
  • 249 Views
  • 2 CrossRef citations
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Article
Screening for low aquatic bioaccumulation (2): physico-chemical constraints
M. Nendza & T. Herbst
Pages: 351-364
Published online: 18 May 2011
AbstractforScreening for low aquatic bioaccumulation (2): physico-chemical constraints | Full Text | References | PDF (406.1 KB) | Supplemental
  • 192 Views
  • 8 CrossRef citations
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Article
Modelling of serotonin reuptake inhibitory and histamine H3 antagonistic activity of piperazine and diazepane amides: QSAR rationales for co-optimization of the activity profiles
B.K. Sharma, P. Singh, M. Shekhawat, K. Sarbhai & Y.S. Prabhakar
Pages: 365-383
Published online: 18 May 2011
AbstractforModelling of serotonin reuptake inhibitory and histamine H3 antagonistic activity of piperazine and diazepane amides: QSAR rationales for co-optimization of the activity profiles | Full Text | References | PDF (517.4 KB) | Supplemental
  • 100 Views
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Article
Fragment-similarity-based QSAR (FS-QSAR) algorithm for ligand biological activity predictions
K.Z. Myint, C. Ma, L. Wang & X.-Q. Xie
Pages: 385-410
Published online: 18 May 2011
AbstractforFragment-similarity-based QSAR (FS-QSAR) algorithm for ligand biological activity predictions | Full Text | References | PDF (1.2 MB)
  • 225 Views
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