Ligand 3D structure preparation SOP
Version 1

This SOP describes the preparation of pteridine ligand 3D structures from SMILES or other input formats with the LigPrep routine as embedded in Schrödinger Maestro for usage in docking runs and in silico ADME-Tox property prediction.


Filename: sop_ligandpreparation.pdf  Download

Format: PDF document

Size: 149 KB

help Creators and Submitter

Views: 1073   Downloads: 50

Created: 22nd Sep 2020 at 10:02

Last updated: 30th Sep 2020 at 10:03

help Attributions


Version History

Version 1 (earliest) Created 22nd Sep 2020 at 10:02 by Ina Poehner

No revision comments

Powered by
Copyright © 2008 - 2023 The University of Manchester and HITS gGmbH