Quantitative Predictions of Protein Solubility Using a QSPR Approach

 Apr 22, 2021  |  11:00 to 11:45  |  Eastern (NY) Time  Biologics

Homology Modeling / Protein Properties Calculations / QSAR/QSPR Modeling / Protein Patch Analysis

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Rebroadcast: Practical Guide: Set Up MOE High-Performance Computing on AWS Cloud

 Jun 02, 2021  |   12:01 AM   |  Viewing Available Until Jun 09, 2021  Small Molecules

Cloud / AWS / HPC / High-Throughput Screening / Large Scale Calculations / SLURM / Amazon Cluster

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Rebroadcast: Biologics: Protein Alignments, Modeling and Docking

 Jun 15, 2021  |   12:01 AM   |  Viewing Available Until Jun 22, 2021  Biologics

Protein Alignments and Superposition / Loop and Linker Modeling / Homology Modeling / Protein- Protein Docking

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Rebroadcast: The Application of Docking and Fragment Replacement to Structure-Based Drug Design

 Jun 16, 2021  |   12:01 AM   |  Viewing Available Until Jun 23, 2021  Small Molecules

Docking / Pharmacophore Modeling / Fragment-Based Design / Scaffold Replacement / Protein-Ligand Interaction Fingerprints (PLIF)

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Rebroadcast: In Silico Fragment-Based Drug Design: Approaches and Applications

 Jun 17, 2021  |   12:01 AM   |  Viewing Available Until Jun 24, 2021  Small Molecules

Scaffold Replacement / Fragment Linking / Ligand Growing / R-Group Screening / Medicinal Chemistry Transformations / Combinatorial Fragment Libraries / Pharmacophore Models / Fragment Databases

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Recently Passed Events

Rebroadcast: Solvent Analysis for Lead Optimization

 Apr 21, 2021  |   12:01 AM   |  Viewing Available Until Apr 28, 2021  Small Molecules

Solvent Analysis / 3D-RISM / Lead Optimization / Water Placement

 

Practical Guide: Set Up MOE High-Performance Computing on AWS Cloud

 Apr 20, 2021  |  11:00 to 11:45  |  Eastern (NY) Time  Small Molecules

Cloud / AWS / HPC / High-Throughput Screening / Large Scale Calculations / SLURM / Amazon Cluster