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Pharmacophoric Models

Activity prediction is based on a list of models (i.e., QSAR models, pharmacophore models, etc.) that are maintained on the server. There is a second level of access so that only authorized users may be allowed to add or delete model entries. [Pg.355]

Recanatini, M., Cavalli, A. and Masetti, M. (2005) In silico modelling-pharmacophores and hERG channel models. Novartis Foundation Symposium, 266171—181, discussion 181—175. [Pg.125]

GPCR Antitarget Modeling Pharmacophore Models to Avoid GPCR-Mediated Side Effects... [Pg.127]

Key words QSAR modeling, pharmacophore modeling, model validation, virtual screening. [Pg.111]

Li, H., Sutter, J., Hoffinann, R. (2000) HypoGen an automated system for generating predictive 3D Pharmacophore Models. Pharmacophore Perception, Development, and use in Drug Designers (Giiner, . F., ed.), International University Line, La Jolla, CA. [Pg.276]

GPCR Anti-target Modeling. Pharmacophore Models to Avoid GPCR-mediated Side-effects... [Pg.284]

CPCR Anti-target Modeling Pharmacophore Models to Avoid CPCR-mediated Side-effects 283... [Pg.388]

Keywords Microtubule targeting agents, Molecular docking, Molecular modeling, Pharmacophore, Quantitative structure-activity relationships, Tubulin... [Pg.216]

Klabunde, T., and Evers, A. (2005). GPCR antitarget modeling Pharmacophore models for biogenic amine binding GPCRs to avoid... [Pg.178]

Li H, Sutter J, Hoffmann R. HypoGen an automated system for generating 3D predictive pharmacophore models. Pharmacophore Perception, Development, and Use in Drug Design. La Jolla Giiner, OF, Int. Univ. Line, 2000 171-189. [Pg.478]

A quick examination of any issue of the Journal of Medicinal Chemistry would reveal one or more papers describing the development and use of pharmacophore models. Pharmacophore models rarely lead directly to clinical candidates because of the relative coarseness of the representation. They are very useful in finding alternative chemotypes that may have more attractive properties for optimisation. Pharmacophore modelling has always been particularly useful for membrane targets, for which direct structural information has been One example is the discovery of novel ligands for the endothelin A... [Pg.99]


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See also in sourсe #XX -- [ Pg.215 , Pg.227 ]




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Antitarget Pharmacophore Models

Application of Pharmacophore Models in Virtual Screening

CATALYST pharmacophoric models

Chemoinformatics pharmacophore model

Cross-Chemotype Pharmacophore Models

Descriptors from a Pharmacophore Model

Direct approaches, pharmacophore modeling

Distance geometry pharmacophore modeling

Docking and Pharmacophore Modelling for Virtual Screening

Dopamine transporter pharmacophore model

Dopamine-transporter inhibitors pharmacophore model

Drug design pharmacophore model

Epothilone pharmacophore model

Food-related components pharmacophore model

Fuzzy Pharmacophore Models

Fuzzy pharmacophore modeling

Grid-based pharmacophore model

Grid-based pharmacophore model GBPM)

HERG pharmacophore model

HIPHOP pharmacophore model

Interpretation pharmacophoric model

Ligand-based Pharmacophore Modeling

Linear QSAR models descriptor pharmacophores

Modeling of Selective Pharmacophores at the arAdrenergic Receptors

Molecular modeling pharmacophore-based ligand

Molecular modelling receptor/pharmacophore mapping

Nicotinic Pharmacophore Models

Paclitaxel/epothilone pharmacophore model

Pharmacophor

Pharmacophore

Pharmacophore Combination Approach From Lock and Key to Passe-Partout Model

Pharmacophore Identification and Pseudo-Receptor Modeling

Pharmacophore Model Generation

Pharmacophore Modelling in SCHRODINGER

Pharmacophore Models as Part of a Multi-step Screening Approach

Pharmacophore Models for Activity Profiling and Parallel Virtual Screening

Pharmacophore Models for Virtual Screening

Pharmacophore Models into Receptor Site

Pharmacophore mapping molecular modelling

Pharmacophore modeling

Pharmacophore modeling

Pharmacophore modeling software

Pharmacophore modelling

Pharmacophore models

Pharmacophore models

Pharmacophore pseudo-receptor models

Pharmacophores

Pharmacophores modeling

Pharmacophores modeling

Pharmacophores published models

Pharmacophoric

Qualitative pharmacophore models

Quantitative pharmacophore models

Structure-based pharmacophore modeling

Supermolecule-Based Subtype Pharmacophore and QSAR Models

Target and Antitarget Pharmacophore Modeling

Validation of Pharmacophore Models

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