[PyMOL] Calculating binding energy of ligand with protein

2020-09-10 Thread mtarazkar
Hi PyMOL user, Is this possible to calculate the binding energy of ligand with protein using Pymol? If yes can you refer me some sources how I can do this task? Thank you Maryam ___ PyMOL-users mailing list Archives: http://www.mail-archive.com/pymol-user

[PyMOL] Optimize the bond distance of ligand with protein

2020-09-10 Thread mtarazkar
Dear Pymol user, I am trying to do molecular docking using Autodock vina. But when I insert the ligand and the protein, the distance of ligand is very far from protein (~7 angstrom) Is there any way to decrease the distance in pymol before doing the docking? Thank you Maryam ___