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Merge commit d30f2cb6 from release-2020 into master
[alexxy/gromacs.git]
/
src
/
gromacs
/
modularsimulator
/
modularsimulator.cpp
2020-01-07
Paul Bauer
Merge commit d30f2cb6 from release-2020 into master
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2019-12-27
Paul Bauer
Merge origin/release-2019 into release-2020
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2019-12-12
Pascal Merz
Fix final configuration writing for modular simulator
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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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2019-10-31
Pascal Merz
Check for contradicting environment variables (modular...
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2019-10-30
Pascal Merz
Fix doxygen for modular simulator
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2019-10-29
Pascal Merz
Fix compatibility check of modular simulator
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2019-10-29
Paul Bauer
Merge branch 'release-2019' into master
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2019-10-27
Pascal Merz
Enable forced rotation for modular simulator
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2019-10-23
Pascal Merz
Fix log writing (modular simulator)
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2019-10-22
Pascal Merz
Fix signal propagation (modular simulator)
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2019-10-22
Pascal Merz
Fix PmeLoadBalanceHelper initialization (modular simulator)
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2019-10-21
Artem Zhmurov
Add environment variable that changes the meaning of...
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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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2019-09-23
Pascal Merz
Parrinello-Rahman for md-vv
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2019-09-23
Pascal Merz
Parrinello-Rahman barostat for modular simulator (leap...
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2019-09-23
Pascal Merz
Introduce FEP into modular simulator
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2019-09-23
Pascal Merz
Fix vrescale thermostat integral (modular simulator)
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2019-09-18
Pascal Merz
v-rescale thermostat for modular simulator
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2019-09-18
Szilárd Páll
Set up workload data structures
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2019-09-17
Pascal Merz
Fix modular simulator MPI bugs
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2019-09-17
Pascal Merz
Make modular simulator the default code path for md...
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2019-09-17
Pascal Merz
Enable checkpointing for modular simulator
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2019-09-15
Pascal Merz
Introduce the modular simulator
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