hello,all members:
I want to use the AMBER to simulation of the small molecule. but I do not have
the FF parameters of this molecule.Can you suggest the parameters for me? If I
pubish the paper ,I will thank you in the paper . the molecule is in pdb file
format.thanks very much!!!
(any suggestion will be helpful and if I get something, I will send to the
pharmacy.man.ac.uk/amber ,which is the AMBER parameter database.
Best regards!
bxiong - at - mail.shcnc.ac.cn
Xiong Bin
Shanghai Institute of Materia Medica, C.A.S.
phone:021-64311833-222(office)
Attachment:
extractlig.pdb
Description: Binary data