If you are referring to the program that has been used in the design of complexes. I have used chemsketch . can you use GaussView program for 3D.

Thanx for replay, but i ask for molecular docking

Personally, I have used Molegro Virtual Docker software (MVD) for docking calculations of metal complexes as ligands into enzymes. I think MVD is more suitable for metal complexes than other softwares.

Hi Mostafa,

AutoDock4 can handle metal ions like Fe, Zn, and Mn:

http://autodock.scripps.edu/

http://autodock.scripps.edu/faqs-help/tutorial

http://autodock.scripps.edu/faqs-help/faq/where-do-i-set-the-autodock-4-force-field-parameters

https://www.youtube.com/playlist?list=PLlBNkYCWCYQHC6aX16z9eUonBzuxs6Wnq

http://chemistry.umeche.maine.edu/Modeling/AutoDock-tutorial.pdf

http://mgl.scripps.edu/forum/viewforum.php?f=9&sid=140cff06d86f8908dbcab53c8e4d9764

http://autodock.scripps.edu/resources/autodockzn-forcefield

Prediction of the interaction of metallic moieties with proteins: An update for protein-ligand docking techniques

October 2017Journal of Computational Chemistry

DOI: 10.1002/jcc.25080

Now i am able to do that with two program MOE and Molegro

What about lanthanides complexes?

Please go to this link :

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.6b00407

HyperChem