24小时热门版块排行榜    

Znn3bq.jpeg
查看: 1158  |  回复: 0

Sion_Wang

铁虫 (初入文坛)

[求助] NAMD CUDA版本在Windows下运行异常求助

由于微星笔记本主板的一些坑,我的笔记本没办法安装Linux,于是只能选择在Windows下跑模拟。

目前希望能使用NAMD的CUDA版本,但是在运行示例时出现了很奇怪的现象:
引用回帖:
......
LDB: Central LB being created...
CUDA device 0 stream priority range 0 -1
Info: Startup phase 9 took 0.000999928 s, 137.801 MB of memory in use
Info: CREATING 430 COMPUTE OBJECTS
Info: Found 213 unique exclusion lists needing 616 bytes
Pe 4 hosts 0 local and 3 remote patches for pe 4
Pe 1 hosts 0 local and 4 remote patches for pe 4
Pe 0 hosts 0 local and 4 remote patches for pe 4
Pe 5 hosts 0 local and 3 remote patches for pe 4
Pe 6 hosts 0 local and 4 remote patches for pe 4
Pe 7 hosts 0 local and 4 remote patches for pe 4
Pe 3 hosts 0 local and 2 remote patches for pe 4
Pe 2 hosts 0 local and 3 remote patches for pe 4
Info: useSync: 0 useProxySync: 0
Info: Startup phase 10 took 0.00300002 s, 140.129 MB of memory in use
Info: Startup phase 11 took 0.000999928 s, 140.129 MB of memory in use
Info: Startup phase 12 took 0 s, 144.016 MB of memory in use
Info: Finished startup at 1.036 s, 144.156 MB of memory in use

TCL: Minimizing for 100 steps

log卡在了能量最小化的地方,无法继续计算,不报任何错误,也没有任何CPU占用。相对地,对于同一计算任务,多核版的NAMD可以正常运算并返回结果。

这个问题让我十分摸不着头脑,在此请求各位伸出援手。

注:CUDA安装没有任何问题,可以正常编译.cu文件,进行矩阵运算。
回复此楼

» 猜你喜欢

已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖
相关版块跳转 我要订阅楼主 Sion_Wang 的主题更新
最具人气热帖推荐 [查看全部] 作者 回/看 最后发表
[基金申请] 国自然上会要求 +5 无名者登山 2026-05-18 9/450 2026-05-18 17:50 by BlakeReary
[考博] 博士申请 +4 星…… 2026-05-18 5/250 2026-05-18 17:34 by 炎甲00
[基金申请] 评审有感 +3 popular289 2026-05-18 6/300 2026-05-18 15:17 by gy116024
[基金申请] 青C资助名额大幅增加! +12 西葫芦炒鸡蛋 2026-05-13 16/800 2026-05-18 10:02 by Equinoxhua
[硕博家园] 我在等一个没有答案的答案 +3 Love_MH 2026-05-17 3/150 2026-05-18 02:22 by 竹林孤影
[硕博家园] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +6 l7k6xnh0yc 2026-05-14 7/350 2026-05-17 19:42 by Equinoxhua
[考研] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +6 cjf4bx70cj 2026-05-14 7/350 2026-05-17 18:49 by Equinoxhua
[考博] 26/27博士推荐 +3 1木头人13949 2026-05-13 3/150 2026-05-17 09:41 by YuY66
[考博] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +3 7hlccowb3h 2026-05-15 4/200 2026-05-17 07:46 by 11n4dfd8yn
[找工作] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +3 l7k6xnh0yc 2026-05-14 6/300 2026-05-17 07:31 by 11n4dfd8yn
[考研] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +4 l7k6xnh0yc 2026-05-14 8/400 2026-05-17 07:26 by 11n4dfd8yn
[公派出国] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +6 l7k6xnh0yc 2026-05-14 6/300 2026-05-17 07:16 by 11n4dfd8yn
[考博] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +6 l7k6xnh0yc 2026-05-14 6/300 2026-05-17 07:11 by 11n4dfd8yn
[博后之家] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +4 k37jurhrau 2026-05-16 4/200 2026-05-17 01:35 by ue3ir18jc3
[考研] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +4 x0mp7owy2b 2026-05-15 4/200 2026-05-17 00:25 by ue3ir18jc3
[高分子] 本人最近太闲了,谁有问题可以提,每天会统一回复 +9 一切都是空工 2026-05-12 20/1000 2026-05-16 19:52 by Equinoxhua
[有机交流] 求助2,4-二氯-5-嘧啶甲醛的合成方法 20+3 光吃不拉 2026-05-14 6/300 2026-05-16 19:46 by Equinoxhua
[硕博家园] 售SCI一区T0P文章,我:8.O.5.5.1.O.5.4,科目齐全,可+急 +4 x0mp7owy2b 2026-05-15 4/200 2026-05-16 17:45 by j6b2pdz07o
[有机交流] 求有机合成大神指点三硫酸乙烯酯(CAS:2793408-99-6)的合成路线 30+3 Leekmid 2026-05-13 10/500 2026-05-16 16:37 by czyzsu
[考博] 26应届毕业生考博求助 +3 wo一定上岸 2026-05-13 3/150 2026-05-14 21:47 by 明海天涯
信息提示
请填处理意见