Hi，gmx users: Recently, I have a question——what's the philosophy of -ci option in "genbox"? My understanding is that a molecule is randomly generated in the hole at first, then a new location around the molecule is generated according to a random seed , then gmx checks whether solve or solute molecules will overlap, and so on. What is correct?
-- Sincerely yours Dr Ji-Nan Niu School of Materials Science and Engineering. China University of Mining and Technology. Jiangsu Province, XuZhou 221116 P. R. China _____________________________________________________ Email: [email protected] Phone: +86-13852039305
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