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- * [[Epik]] and [[ligprep]] from Schrodinger1 KB (154 words) - 11:48, 20 March 2014
- ===Troubleshooting: Ligprep fails "FATAL: Error: in replying to 'JPROXYPORT'"=== ===Troubleshooting: Ligprep's multi-process jobs only finishes a single process===15 KB (2,301 words) - 19:07, 18 March 2024
- ...s critical to a successful FEP+ prediction. Best practices include running LigPrep on all the compounds to exhaustively enumerate all the stereoisomers and li ...the workspace, recommend that you import smiles or a mol2 file. Use the '''LigPrep''' tool to build the ligands into a 3D dockable format. Consider generating5 KB (754 words) - 19:55, 8 February 2024