hi Ife,
yes, there is a known memory leakage issue when using NVIDIA GPU with OpenCL (mmclab/mcxlabcl), see these previous threads
https://groups.google.com/g/mmc-users/c/Ryzx_JTBBsM/m/x97x54kMAgAJ
https://groups.google.com/g/mcx-users/c/f31KBsmj5aw/m/H_fabg3zAwAJ
https://groups.google.com/g/mmc-users/c/1XFeeeKz_nw/m/QymqydiICQAJ
since v2023, mmc supports triple-backend - sse4, opencl and cuda - in the trinity-build. running mmclab with cuda backend (cfg.compute='cuda') does not have this leakage issue.
in the mmclab download folder, we have provided a precompiled mex file support cuda, but only for Linux:
mmclab-trinity-linux-x86_64-v2025.10.zip, see https://sourceforge.net/projects/mcx/files/mmc/mmclab/2.8%20%28v2025.10%20Bubble%20Tea%29/
it is possible to build it for Windows, but I haven't found time to setup the build environment. you can't run cuda on MacOS unfortunately.
Qianqian
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