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p2rank/distro/test_data
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rdk 8614bed9c5 add pocketeer output examples and schema
2026-02-11 08:38:02 +01:00
..
apoholo
support apo-holo datasets for training and evaluation
2023-08-05 13:41:09 +02:00
clean
add mmcif parsing
2021-12-09 03:44:10 +01:00
liganated
add mmcif parsing
2021-12-09 03:44:10 +01:00
predictions
add pocketeer output examples and schema
2026-02-11 08:38:02 +01:00
1fbl_pymol.cif
fail on config parse error
2022-06-02 11:20:25 +02:00
1fbl.bcif
support BinaryCIF (bcif) input format
2023-11-17 04:25:38 +01:00
1fbl.cif
add mmcif parsing
2021-12-09 03:44:10 +01:00
1fbl.cif.gz
add implementation of transform/reduce-to-chains command
2021-12-12 11:07:11 +01:00
1fbl.cif.zst
add zst compressed files to test data
2023-08-01 20:38:59 +02:00
1fbl.pdb
fixed rescoring, improved documentation of test_data, log_to_file=true by default
2019-03-22 09:41:30 +01:00
1fbl.pdb.gz
improved readme
2016-09-28 13:42:57 +02:00
1fbl.pdb.zst
add more zst compressed files to test data
2023-08-01 20:50:43 +02:00
2W83.bcif.gz
support BinaryCIF (bcif) input format
2023-11-17 04:25:38 +01:00
2W83.cif
update tests for mmcif
2021-12-09 03:52:45 +01:00
2W83.cif.gz
add implementation of transform/reduce-to-chains command
2021-12-12 11:07:11 +01:00
2W83.cif.zst
add zst compressed files to test data
2023-08-01 20:38:59 +02:00
2W83.pdb
Initial commit (version 2.0_RC1)
2016-09-27 09:30:03 +02:00
2W83.pdb.gz
add implementation of transform/reduce-to-chains command
2021-12-12 11:07:11 +01:00
2W83.pdb.zst
add more zst compressed files to test data
2023-08-01 20:50:43 +02:00
basic.ds
documentation cleanup and test script for conservation model
2020-04-01 17:45:27 +02:00
concavity.ds
add PUResNet rescoring, change name of rescoring output file (from <prediction>_rescored.csv to <protein>_rescored.csv)
2024-05-31 04:25:41 +02:00
fpocket3.ds
add PUResNet rescoring, change name of rescoring output file (from <prediction>_rescored.csv to <protein>_rescored.csv)
2024-05-31 04:25:41 +02:00
fpocket.ds
add PUResNet rescoring, change name of rescoring output file (from <prediction>_rescored.csv to <protein>_rescored.csv)
2024-05-31 04:25:41 +02:00
pocketeer.ds
add pocketeer output examples and schema
2026-02-11 08:38:02 +01:00
puresnet.ds
fix PUResNetV2.0 label
2024-10-19 16:00:01 +02:00
readme.md
improve readme files in distro
2020-11-05 17:52:16 +01:00
specified-chains-and-ligands.ds
multi-chain reduced structures: allows to specifiy multiple chains in a dataset file
2020-03-22 23:27:40 +01:00
specified-chains.ds
documentation cleanup and test script for conservation model
2020-04-01 17:45:27 +02:00
specified-ligands-2.ds
fix typos in documantation
2020-11-17 18:24:18 +01:00
specified-ligands.ds
add mmcif parsing
2021-12-09 03:44:10 +01:00
test.ds
add mmcif parsing
2021-12-09 03:44:10 +01:00

readme.md

This directory contains example input data.

See doc/dataset-file-format.md and comments in example *.ds files.

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