Fragment Based Drug Design - Add Group to Ligand
This video covers the Fragment-Based Drug Design tools in MOE, specifically using the Add Group to ligand operation for growing a ligand into a subpocket.
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=30&autoplay=1[label]0:30 Loading a structure[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=75&autoplay=1[label]1:15 Structure preparation with QuickPrep[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=181&autoplay=1[label]3:01 Rendering using the System Manager[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=244&autoplay=1[label]4:04 Binding pocket analysis using Surfaces[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=304&autoplay=1[label]5:04 Identifying connections with Ligand R-Vectors[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=338&autoplay=1[label]5:38 Setting up the Add Group to Ligand panel[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=441&autoplay=1[label]7:41 Encoding key interactions using the Pharmacophore Editor[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=583&autoplay=1[label]9:43 Minimizing and scoring newly generated ligands[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=700&autoplay=1[label]11:40 Rank ordering results using the Database Viewer[link end]
[link]video.chemcomp[d]com/watch/g2sdwMv2Jk7bqpPm5RDGjH?second=734&autoplay=1[label]12:14 Qualitative analysis using the Database Browser[link end]
