Wei-Tse Hsu comments

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                                            Wei-Tse Hsu

Issued with `gmx mdrun -rerun -plumed`

Hi Dr. Bussi, I had a problem that might be related to this issue. Recently our group has been working on testing of adding alchemical variables in PLUMED. (We patched...

Issued with `gmx mdrun -rerun -plumed`

Thank you for your reply and my apologies for causing confusion! The tpr file can be downloaded [here](https://drive.google.com/file/d/1ZWt8UxCjTvgJHEGpXV2Gl4GI_cqV1r2I/view?usp=sharing).

A problem with slicing in subsampling

Hi @dotsdl, it would be great if the issue will be fixed! Also thank you for the detailed explanation!

A problem with slicing in subsampling

Hi @dotsdl, no worries at all, and thanks for following up! So I just tried first upgrading my version of `pandas` (to version 1.11.0) and using `alchemlyb` on the master...

A problem of file parsing for simulations with multiple coupled states

Hi @mrshirts and @dotsdl, Thank you for your responses! Sorry that I didn't see the replies until this morning. I just ran a replica-exchange simulation of 28 states with 500...