Three-dimensional molecular field analyses of octopaminergic agonists and antagonists for the locust neuronal octopamine receptor class 3

Akinori Hirashima; Takumi Nagata; Canping Pan; Eiichi Kuwano; Eiji Taniguchi; Morifusa Eto

doi:10.1016/S1093-3263(99)00031-5

Three-dimensional molecular field analyses of octopaminergic agonists and antagonists for the locust neuronal octopamine receptor class 3

Akinori Hirashima, Takumi Nagata, Canping Pan, Eiichi Kuwano, Eiji Taniguchi, Morifusa Eto

Molecular Biosciences

Research output: Contribution to journal › Article › peer-review

5 Citations (Scopus)

Abstract

The quantitative structure-activity relationship (QSAR) of a set of 70 octopaminergic agonists and 20 antagonists against octopamine receptor class 3 (OAR3) in locust nervous tissue was analyzed by molecular field analysis (MFA). MFA of these compounds evaluated effectively the energy between a probe and a molecular model at a series of points defined by a rectangular grid. Contour surfaces for the molecular fields are presented. These results provide useful information in the characterization and differentiation of octopaminergic receptor types and subtypes. (C) 2000 by Elsevier Science Inc.

Original language	English
Pages (from-to)	198-206
Number of pages	9
Journal	Journal of Molecular Graphics and Modelling
Volume	17
Issue number	3-4
DOIs	https://doi.org/10.1016/S1093-3263(99)00031-5
Publication status	Published - Jun 1999

All Science Journal Classification (ASJC) codes

Spectroscopy
Physical and Theoretical Chemistry
Computer Graphics and Computer-Aided Design
Materials Chemistry

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10.1016/S1093-3263(99)00031-5

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title = "Three-dimensional molecular field analyses of octopaminergic agonists and antagonists for the locust neuronal octopamine receptor class 3",

abstract = "The quantitative structure-activity relationship (QSAR) of a set of 70 octopaminergic agonists and 20 antagonists against octopamine receptor class 3 (OAR3) in locust nervous tissue was analyzed by molecular field analysis (MFA). MFA of these compounds evaluated effectively the energy between a probe and a molecular model at a series of points defined by a rectangular grid. Contour surfaces for the molecular fields are presented. These results provide useful information in the characterization and differentiation of octopaminergic receptor types and subtypes. (C) 2000 by Elsevier Science Inc.",

author = "Akinori Hirashima and Takumi Nagata and Canping Pan and Eiichi Kuwano and Eiji Taniguchi and Morifusa Eto",

note = "Funding Information: This work was supported in part by a Grant-in-Aid for Scientific Research from the Ministry of Education, Science, and Culture of Japan.",

year = "1999",

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doi = "10.1016/S1093-3263(99)00031-5",

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T1 - Three-dimensional molecular field analyses of octopaminergic agonists and antagonists for the locust neuronal octopamine receptor class 3

AU - Hirashima, Akinori

AU - Nagata, Takumi

AU - Pan, Canping

AU - Kuwano, Eiichi

AU - Taniguchi, Eiji

AU - Eto, Morifusa

N1 - Funding Information: This work was supported in part by a Grant-in-Aid for Scientific Research from the Ministry of Education, Science, and Culture of Japan.

PY - 1999/6

Y1 - 1999/6

N2 - The quantitative structure-activity relationship (QSAR) of a set of 70 octopaminergic agonists and 20 antagonists against octopamine receptor class 3 (OAR3) in locust nervous tissue was analyzed by molecular field analysis (MFA). MFA of these compounds evaluated effectively the energy between a probe and a molecular model at a series of points defined by a rectangular grid. Contour surfaces for the molecular fields are presented. These results provide useful information in the characterization and differentiation of octopaminergic receptor types and subtypes. (C) 2000 by Elsevier Science Inc.

AB - The quantitative structure-activity relationship (QSAR) of a set of 70 octopaminergic agonists and 20 antagonists against octopamine receptor class 3 (OAR3) in locust nervous tissue was analyzed by molecular field analysis (MFA). MFA of these compounds evaluated effectively the energy between a probe and a molecular model at a series of points defined by a rectangular grid. Contour surfaces for the molecular fields are presented. These results provide useful information in the characterization and differentiation of octopaminergic receptor types and subtypes. (C) 2000 by Elsevier Science Inc.

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ER -

Three-dimensional molecular field analyses of octopaminergic agonists and antagonists for the locust neuronal octopamine receptor class 3

Abstract

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