定制各类格氏试剂

问题:可以算mm3的免费的计算软件TINKER
类型:推荐
提问:kez
等级:▲▲▲
版块:计算化学资源()
信誉:84%
回复:4
阅读:1412
时间:2005-02-27 18:02:48  编辑    加入/取消收藏    订制/取消短消息    举报该贴    

The TINKER molecular modeling software is a complete and general package for molecular mechanics and dynamics, with some special features for biopolymers. TINKER has the ability to use any of several common parameter sets, such as Amber (ff94, ff96, ff98 and ff99), CHARMM (19 and 27), Allinger MM (MM2-1991 and MM3-2000), OPLS (OPLS-UA, OPLS-AA and OPLS-AA/L), Liam Dang's polarizable potentials, and our own AMOEBA polarizable atomic multipole force field. Parameter sets for other standard force fields such as GROMOS, UFF, ENCAD and MM4 are under consideration for future releases.

http://dasher.wustl.edu/tinker/


回复人:zbqxwd2, () 时间:2006-03-01 17:38:51   编辑 1楼
资源不错,加0.1分


回复人:fengyu211,▲▲▲ (有东东共享) 时间:2006-03-17 23:15:29   编辑 2楼
资源不错,加0.3分


回复人:njpich, () 时间:2006-05-09 22:21:11   编辑 3楼
资源不错,加0.3分


回复人:flychem, () 时间:2006-06-15 08:20:24   编辑 4楼
资源不错,加0.3分




问题讨论没有结束...
您尚未进入本论坛,登录之后才可以回贴
用户名:密码:    游客  新用户免费注册
6msec



版权所有 中国化学化工论坛 
可转载本站文章 但请务必注明出处 本站法律顾问 方利律师  
www.ccebbs.com E-Mail:ccebbs00@126.com
Chinese Chemistry and Chemical Engineering BBS