生物分子模拟论坛

 找回密码
 我想注册

QQ登录

只需一步,快速开始

扫一扫,访问微社区

查看: 2904|回复: 0

[YASARA] YASARA重要更新汇总

[复制链接]
发表于 2014-6-29 22:20:21 | 显示全部楼层 |阅读模式

马上注册,结交更多好友,下载更多分子模拟资源。

您需要 登录 才可以下载或查看,没有帐号?我想注册

x
New highlight: YASARA's MD algorithms have been largely rewritten to boost performance. On an Intel Core i7 4770, this YASARA release reaches 81ns/day in the DHFR benchmark, which is almost 3x as fast as previous YASARA versions. Since countless additional things changed in this release (including new compilers), please consider making a backup of your current YASARA before updating.
今年5月1号,YASARA发布重要更新,其MD模块重新编写,其速度是原始版本的3倍左右,而根据之前在自己机器上的实测,YASARA原版本(13.9.8)的运算速度大约为GROMACS4.6.5的60%,同时,YASARA最近也将推出GPU版本,尽请期待
您需要登录后才可以回帖 登录 | 我想注册

本版积分规则

QQ|分迪科技|小黑屋|手机版|Archiver|生物分子模拟论坛 ( 蜀ICP备14009200号-3 )

GMT+8, 2024-4-27 02:58 , Processed in 0.062712 second(s), 19 queries .

Powered by Discuz! X3.4

Copyright © 2001-2020, Tencent Cloud.

快速回复 返回顶部 返回列表