Molecular Operating Environment v2007.09

M

midat2002

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Molecular Operating Environment v2007.09 integrates tools for computer-assisted drug discovery. Explore MOE's functionality in the following areas: Pharmacophore Discovery, Protein Modeling & Bioinformatics Medicinal Chemistry Applications, Molecular Modeling & Simulations, Structure-Based Design, Cheminformatics & QSAR, and, High Throughput Discovery.​



Pharmacophore Discovery
~~~~~~~~~~~~~~~~~~~~~~~~~
Scaffold Replacement
Pharmacophore Elucidation
Pharmacophore Search
High Throughput Conformational Analysis
Pharmacophore Query Editor
Pharmacophore Consensus​



Protein Modeling & Bioinformatics
~~~~~~~~~~~~~~~~~~~~~~~~~
Protein Structure & Family Databases
Fold Identification
Structural Family Analysis
Mutation & Rotamer Exploration
Multiple Alignment
Homology Modeling
Structural Quality Assessment​



Medicinal Chemistry Applications
~~~~~~~~~~~~~~~~~~~~~~~~~
MOE/web
LigX : Ligand Explorer
Ligand:protein Interaction Diagrams
Molecular Surfaces and Maps
Scaffold Replacement
Molecular Descriptors
Flexible Alignment of Small Molecules​



Molecular Modeling & Simulations
~~~~~~~~~~~~~~~~~~~~~~~~~
Builders & Data Import/Export
Molecular Mechanics & Dynamics
Implicit Solvent Electrostatics
Conformational Analysis
Flexible Alignment of Small Molecules
Diffraction Simulation
Quantum Calculations​



Structure-Based Design
~~~~~~~~~~~~~~~~~~~~~~~~~
Active Site Detection
Ligand:protein Interaction Diagrams
Molecular Surfaces and Maps
Protonate3D
Ligand-Receptor Docking
Multi-Fragment Search
LigX : Ligand Explorer​



Cheminformatics & QSAR
~~~~~~~~~~~~~~~~~~~~~~~~~
SD Pipeline Command Line Tools
Tautomer and Titration Enumeration
Molecular Descriptors
Similarity, Diversity & Fingerprints
High Throughput Conformational Search
QSAR/QSPR Predictive Modeling
Consensus Modeling​



High Throughput Discovery
~~~~~~~~~~~~~~~~~~~~~~~~~
VSA Descriptors
HTS-Binary QSAR
Focused Combinatorial Library Design
Diverse Combinatorial Library Design
Combinatorial Library Enumeration
RECAP Analysis and Synthesis​



Methods Development & Deployment
~~~~~~~~~~~~~~~~~~~~~~~~~
Scientific Vector Language (SVL)
Background Computing
Cluster Computing
Computer Platforms
Java Subsystem
MOE/web​








iNSTALL iNFO:
1.) unpack the files
2.) burn or mount the image
3.) install
4.) Check Shooters dir !​









torrent
http://rapidshare.com/files/17442565...all.vn_MOE.rar


المشاركة الأصلية بواسطة medo_2006456​
 


اولا الف الف شكر عالبرنامج ده لاني فعلا دايخ عليه والله بقالي سنة
بس ياتري البرنامج كامل ؟
ولو له كراك او باتش فيه طريقة معينة لتفعيله
ثانيا بارك الله فيك
 


السلام عليكم
أ رجو المعدرة كنت غائب في سفر..
لا يوجد باسوارد

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م.مصطفى
 
alsalam 3leikm wara7mat ALLAH, Thanks for your effort this program is really important for me & I have downloaded it but upon extraction it requires a password, please help
 
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