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Molecular Operating Environment
Integrated Computer-Aided Molecular Design Platform
Small Molecules - Peptides - Biologics
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Antibody and Biologics Design
Preparing a raw PDB file containing multiple ligands
This video shows how to prepare a raw PDB file containing more than 1 ligand for use in MOE for tasks such as interactive analy...
Oct-18-2023
Preparing a raw PDB file for use in MOE
This video shows how to prepare a raw PDB file for use in MOE for tasks such as interactive analysis or Docking. [link]video....
Oct-18-2023
Computing molecular properties for a database of small molecules using Calculate Descriptors
This video shows how to compute molecular properties for a database of molecules for tasks such as filtering, building QSAR mod...
Nov-21-2023
Using Surface and Maps to Understand Properties and HotSpots
This video shows how to generate visual representations of molecular surfaces and hotspots with examples applied to a protein-l...
Feb-09-2024
Structure-Based Charge Calculations for Predicting Properties and Profiling Antibody Therapeutics
In this work, we present a method for modeling antibodies and performing pH-dependent conformational sampling, which can enhanc...
Dec-18-2023
New and Enhanced Features in MOE 2024.06
CCG is pleased to announce the 2024 release of the Molecular Operating Environment, MOE. In this webinar we will present new fe...
Oct-03-2024
Antibody Modeling and Developability Assessment
Antibody candidates often have poor biophysical properties and/or chemical liabilities that cause downstream developability iss...
Nov-21-2023
Protein Surface Charge and Hydrophobic Patch Analysis
Protein patch analysis is a computational method for identifying and assessing protein interaction hot spots which may be impli...
Nov-21-2023
Creating and Analyzing Focused Mutant Libraries for Protein Engineering
Computational techniques for optimizing the affinity of a potential therapeutic protein or antibody are described. Experimental...
Nov-21-2023
Developability Assessment & Property Prediction by pH-Dependent Conformational Sampling
mAb candidates identified from high-throughput screening or binding affinity optimization often present liabilities for develop...
Nov-21-2023
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