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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 |
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