Title: QM Theory Benchmark  
Owner: Simon Boothroyd
Creator: Simon Boothroyd Apr 08, 2021
Last Changed by: Pavan Behara Oct 07, 2021
Tiny Link: (useful for email) https://openforcefield.atlassian.net/wiki/x/GIAnX
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Force Fields (1)
    Page: QM Data Generation
Hierarchy
Children (2)
    Page: Theory Benchmarking Set Generation Scheme
    Page: Current status
Labels
Global Labels (1)
Time Editor  
Oct 07, 2021 00:07 Pavan Behara View Changes
Oct 06, 2021 21:03 Pavan Behara View Changes
Aug 23, 2021 20:57 Pavan Behara View Changes
Jun 30, 2021 03:13 Pavan Behara View Changes
Jun 30, 2021 03:12 Pavan Behara  
Outgoing Links
External Links (13)
    https://dx.doi.org/10.1021/acs.jpclett.1c00426
    doi.org/10.1021/acs.jctc.1c00006
    https://openforcefield.atlassian.net/wiki/spaces/FF/pages/1…
    https://github.com/openforcefield/qca-dataset-submission/bl…
    https://drive.google.com/file/d/1V7XpmOclYeBeO9Zy0Z5R-7ggPi…
    https://openforcefieldgroup.slack.com/archives/CJQ4DCWN8/p1…
    dx.doi.org/10.1021/ct5004725
    https://docs.google.com/presentation/d/12l19i6r8ra2p9a0iMJe…
    https://github.com/openforcefield/qca-dataset-submission/pu…
    https://github.com/openforcefield/qca-dataset-submission/pu…
    https://github.com/openforcefield/qca-dataset-submission/pu…
    https://docs.google.com/document/d/1tMoJY0J2E6uRltvL4gJv7og…
    https://github.com/MobleyLab/qm-theory-benchmark
Force Fields (2)     Page: QM Theory Benchmark
    Page: Theory Benchmarking Set Generation Scheme