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Pass restraint data structures to bonded functions
[alexxy/gromacs.git]
/
src
/
gromacs
/
listed_forces
/
bonded.cpp
2021-02-19
ejjordan
Pass restraint data structures to bonded functions
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2021-02-12
Mark Abraham
Merge branch release-2021 into master
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2021-01-29
Mark Abraham
Merge branch release-2021
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2021-01-07
Paul Bauer
Merge branch release-2020 into merge-2020-into-2021
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2020-12-18
Mark Abraham
Merge branch release-2021
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2020-12-16
M. Eric Irrgang
Apply re-formatting to C++ in src/ tree.
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2020-11-24
Paul Bauer
Merge branch 'origin/release-2020' into merge-2020...
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2020-10-20
Paul Bauer
Merge branch 'origin/release-2020' into merge-release...
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2020-10-19
Andrey Alekseenko
Fix random doxygen warnings and typos
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2020-10-14
Mark Abraham
Fix bonded tests
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2020-10-07
Paul Bauer
Merge branch 'origin/release-2020' into merge-release...
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2020-09-02
Gilles Gouaillardet
Fix improved SIMD angles()
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2020-08-31
Paul Bauer
Merge branch 'release-2020' into master
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2020-08-28
Berk Hess
Add SIMD version of harmonic bonds
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2020-08-14
Berk Hess
Add SIMD bonded tests and improve SIMD angles()
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2020-06-24
Berk Hess
Add class ListedForces
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2020-05-06
Paul Bauer
Merge branch 'origin/release-2020' into master
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2020-04-28
Roland Schulz
Add clang WA
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2020-04-28
Roland Schulz
Fix MSVC 2019 test failures
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2020-04-03
M. Eric Irrgang
Prune change-management.rst and update links.
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2020-03-18
Berk Hess
Remove use of graph in do_force()
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2020-03-04
Paul Bauer
Merge branch release-2020 into master
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2020-02-28
Paul Bauer
Merge branch release-2019 into release-2020
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2020-01-28
Paul Bauer
Merge branch origin/release-2020 into master
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2020-01-09
Mark Abraham
Split lines with many copyright years
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2020-01-08
Roland Schulz
Merge release-2019 into release-2020
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2020-01-07
Paul Bauer
Merge branch origin/release-2020 into master
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2019-12-31
Mark Abraham
Avoid 386 O3 codegen bug even more
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2019-12-27
Paul Bauer
Merge origin/release-2019 into release-2020
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2019-12-12
Mark Abraham
Merge "Merge branch 'origin/release-2020' into master"
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2019-12-12
Paul Bauer
Merge branch 'origin/release-2020' into master
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2019-12-06
Mark Abraham
Avoid 386 O3 codegen bug
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2019-11-29
Mark Abraham
Merge branch release-2019 into release-2020
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2019-11-20
Paul Bauer
Merge 'origin/release-2019' into release-2020
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2019-11-07
Paul Bauer
Apply clang-format to source tree
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2019-10-29
Paul Bauer
Merge branch 'release-2019' into master
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2019-09-25
Szilárd Páll
Merge remote-tracking branch 'origin/release-2019'
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2019-09-24
Mark Abraham
Merge "Merge branch release-2019 into master"
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2019-09-24
Paul Bauer
Merge branch release-2019 into master
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2019-09-06
Christian Blau
Adding energy output field for density fitting
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2019-09-02
Berk Hess
Only use fshift when needed
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2019-08-22
Mark Abraham
Merge branch release-2019
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2019-08-20
Berk Hess
Merge two dihedral functions
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2019-08-20
Berk Hess
Make bonded virial computation conditional
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2019-08-15
Berk Hess
Template bonded interactions on kernel flavor
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2019-08-09
Berk Hess
Move bonded function table into bonded.cpp
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2019-08-01
Paul Bauer
Merge release-2019 into master
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2019-03-02
Mark Abraham
Merge branch release-2019
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2019-02-20
Paul Bauer
Merge branch 'release-2019' into master
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2019-02-18
David van der Spoel
Precision fix for rescbt code.
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2019-02-04
Roland Schulz
Rename all source files from - to _ for consistency.
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2019-02-02
Roland Schulz
Renamed listed-forces to listed_forces
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