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add an option to merge data to one H5 file#1119

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wanghan-iapcm merged 1 commit intodeepmodeling:develfrom
njzjz:one_h5
Jan 19, 2023
Merged

add an option to merge data to one H5 file#1119
wanghan-iapcm merged 1 commit intodeepmodeling:develfrom
njzjz:one_h5

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@njzjz njzjz commented Jan 17, 2023

Fix #617.

Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
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njzjz commented Jan 18, 2023

Below is the test on my systems:

INFO:dpgen:Combining 45929 training systems to iter.000007/00.train/data.hdf5...
INFO:dpgen:-------------------------iter.000007 task 01--------------------------
2023-01-17 18:01:36,925 - INFO : info:check_all_finished: False
2023-01-17 18:01:36,925 - INFO : remote path: /scratch/jz748/dpgen_workdir/5351930e3552f5d9c883518f7e9e839f81cce2aa
2023-01-17 18:04:23,468 - INFO : job: 82764aa11f3b7d0d57c49a263df5405f75da2720 submit; job_id is 24121180

A 1.7GB file is generated:

-rw-r--r--  1 jz748 york 1.7G Jan 17 17:59 data.hdf5

@wanghan-iapcm wanghan-iapcm merged commit fb8668b into deepmodeling:devel Jan 19, 2023
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[Feature Request] Use HDF5 instead of numpy files

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