Results 211 to 220 of about 36,144 (247)
Some of the next articles are maybe not open access.
???????????????? QSAR ?????????????? ?????? ???????????? ?????????????????????? ????????????????
2015?????????????? ??????i QSAR ??????????i ?????? ???????????? i????i??i??????i?? ??????????i????. ????????i?????? ???????????????? ?????? ???????????????????? ???? ???????????????? ??????i?????? ?????????????????? Ac = 0,96 ?? 0,97 ???? Ac = 0,95 ?? 0,97 ??i????????i??????. ?????? ???????????????? ?????????????? ??????????????????????
openaire +3 more sources
2012
Structure-activity relationship (SAR) and quantitative structure-activity relationship (QSAR) models are increasingly used in toxicology, ecotoxicology, and pharmacology for predicting the activity of the molecules from their physicochemical properties and/or their structural characteristics. However, the design of such models has many traps for unwary
openaire +2 more sources
Structure-activity relationship (SAR) and quantitative structure-activity relationship (QSAR) models are increasingly used in toxicology, ecotoxicology, and pharmacology for predicting the activity of the molecules from their physicochemical properties and/or their structural characteristics. However, the design of such models has many traps for unwary
openaire +2 more sources
Journal of Computer-Aided Molecular Design, 2004
3D-QSAR is typically used to construct models (1) to predict activities, (2) to illustrate significant regions, and (3) to provide insight into possible interactions. To the contrary, examples are described herein which make it clear that the predictivity of such models remains elusive, that so-called significant regions are subject to the vagaries of ...
openaire +2 more sources
3D-QSAR is typically used to construct models (1) to predict activities, (2) to illustrate significant regions, and (3) to provide insight into possible interactions. To the contrary, examples are described herein which make it clear that the predictivity of such models remains elusive, that so-called significant regions are subject to the vagaries of ...
openaire +2 more sources
Progress in clinical and biological research, 1989
A multivariate analysis of phytotoxicity and measured ecotoxicity data of a set of 30 herbicidal triazines was carried out. Results indicate that it is feasible to design triazines that combine limited ecotoxicity with high herbicidal potency.
M. L. Tosato +6 more
openaire +2 more sources
A multivariate analysis of phytotoxicity and measured ecotoxicity data of a set of 30 herbicidal triazines was carried out. Results indicate that it is feasible to design triazines that combine limited ecotoxicity with high herbicidal potency.
M. L. Tosato +6 more
openaire +2 more sources
“NanoBRIDGES” software: Open access tools to perform QSAR and nano-QSAR modeling
Chemometrics and Intelligent Laboratory Systems, 2015Pravin Ambure +2 more
exaly