Molecular Operating Environment v2008.10
MolecularOperatingEnvironmentv2008.10英文正式版(藥物研發可視化仿真)
破解說明:
1.CheckShootersdir
內容說明:
MolecularOperatingEnvironment(MOE藥物研發可視化仿真)

MOE:藥物研發可視化仿真環境

MOE(MolecularOperatingEnvironment)
是藥物研發環境，它具有可視化特點，用於藥物與方法的研發仿真。MOE應用範圍廣泛，
用戶包括全球各地生物技術和製藥企業組織。MOE使用自成一體的編程系統，以及SVL
(ScientificVector
Language,科學向量語言)。SVL是一種化學專業易於接受的腳本語言，專門用於生命科學
的應用開發。

MOE由以下幾個功能部件構成：

*PharmacophoreDiscovery藥效發現
*ProteinModeling&Bioinformatics蛋白質建模與生物資訊學
*MedicinalChemistryApplications藥物化學應用
*MolecularModeling&Simulations分子建模與仿真
*Structure-BasedDesign基於結構的設計
*Cheminformatics&QSAR化學資訊學及構效關係

PharmacophoreDiscovery
~~~~~~~~~~~~~~~~~~~~~~~~~
ScaffoldReplacement
PharmacophoreElucidation
PharmacophoreSearch
HighThroughputConformationalAnalysis
PharmacophoreQueryEditor
PharmacophoreConsensus

ProteinModeling&Bioinformatics
~~~~~~~~~~~~~~~~~~~~~~~~~
ProteinStructure&FamilyDatabases
FoldIdentification
StructuralFamilyAnalysis
Mutation&RotamerExploration
MultipleAlignment
HomologyModeling
StructuralQualityAssessment

MedicinalChemistryApplications
~~~~~~~~~~~~~~~~~~~~~~~~~
MOE/web
LigX:LigandExplorer
Ligand:ProteinInteractionDiagrams
MolecularSurfacesandMaps
ScaffoldReplacement
MolecularDescriptors
FlexibleAlignmentofSmallMolecules

MolecularModeling&Simulations
~~~~~~~~~~~~~~~~~~~~~~~~~
Builders&DataImport/Export
MolecularMechanics&Dynamics
ImplicitSolventElectrostatics
ConformationalAnalysis
FlexibleAlignmentofSmallMolecules
DiffractionSimulation
QuantumCalculations

Structure-BasedDesign
~~~~~~~~~~~~~~~~~~~~~~~~~
ActiveSiteDetection
Ligand:ProteinInteractionDiagrams
MolecularSurfacesandMaps
Protonate3D
Ligand-ReceptorDocking
Multi-FragmentSearch
LigX:LigandExplorer

Cheminformatics&QSAR
~~~~~~~~~~~~~~~~~~~~~~~~~
SDPipelineCommandLineTools
TautomerandTitrationEnumeration
MolecularDescriptors
Similarity,Diversity&Fingerprints
HighThroughputConformationalSearch
QSAR/QSPRPredictiveModeling
ConsensusModeling

HighThroughputDiscovery
~~~~~~~~~~~~~~~~~~~~~~~~~
VSADescriptors
HTS-BinaryQSAR
FocusedCombinatorialLibraryDesign
DiverseCombinatorialLibraryDesign
CombinatorialLibraryEnumeration
RECAPAnalysisandSynthesis

MethodsDevelopment&Deployment
~~~~~~~~~~~~~~~~~~~~~~~~~
ScientificVectorLanguage(SVL)
BackgroundComputing
ClusterComputing
ComputerPlatforms
JavaSubsystem
MOE/web
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