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 features and enhancements in MOE 2024.06, extending the suite of computer-aided molecular design applications to include:
- Capture - Document and Share Design Sessions
- Pharmacophore-guided High-throughput Biologics Virtual Screening
- Map 2D Protein Patch Differences and Ensemble Averages
- Updated Amber: EHT Forcefield Parameters from Atom Hybridization Character
- Predict ECD and ORD Spectra to Determine Stereochemistry and Conformational Ensemble
- Support for Non-natural RNA Bases, Ribose Backbones, and Ionization
- Tautomeric States - Interactive Database Viewer Property Filter
Airdate: October 3
[link]video.chemcomp[d]com/watch/EH7iZ92cGsZQfqpCrxNRce?second=46&autoplay=1[label]0:46 Capture Design Ideas[link end]
[link]video.chemcomp[d]com/watch/EH7iZ92cGsZQfqpCrxNRce?second=193&autoplay=1[label]3:13 Interactive Database Filtering[link end]
[link]video.chemcomp[d]com/watch/EH7iZ92cGsZQfqpCrxNRce?second=245&autoplay=1[label]4:05 MOEsaic QSAR/QSPR and Property Heatmaps[link end]
[link]video.chemcomp[d]com/watch/EH7iZ92cGsZQfqpCrxNRce?second=349&autoplay=1[label]5:49 Improved AmberEHT Forcefield, Open FF, and Conformers[link end]
[link]video.chemcomp[d]com/watch/EH7iZ92cGsZQfqpCrxNRce?second=1037&autoplay=1[label]17:17 Determine Absolute Stereochemistry with ECD & ORD[link end]
[link]video.chemcomp[d]com/watch/EH7iZ92cGsZQfqpCrxNRce?second=1178&autoplay=1[label]19:38 Enhanced Protein Alignments & Superpositions[link end]
[link]video.chemcomp[d]com/watch/EH7iZ92cGsZQfqpCrxNRce?second=1262&autoplay=1[label]21:02 PSILO Interface, Deposit, and Authentication Enhancements [link end]
[link]video.chemcomp[d]com/watch/EH7iZ92cGsZQfqpCrxNRce?second=1437&autoplay=1[label]23:57 MOE 2024.06 Demos[link end]
