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Commits
: Listings
Analyzed
12 months
ago. based on code collected
12 months
ago.
Jan 16, 2023 — Jan 16, 2024
Showing page 1 of 4
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Update CONTRIBUTING.md (#4382)
DaneJacobson
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about 1 year ago
Fixes formatting issue for "sub" tag conversion in Python API documentation (#4375)
Carlos Bueno
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about 1 year ago
Fixed errors in OpenCL on CPU (#4358)
Peter Eastman
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about 1 year ago
Fixed error in barostat (#4364)
Peter Eastman
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about 1 year ago
setVelocitiesToTemperature() works with massless Drude particles (#4356)
Peter Eastman
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about 1 year ago
Faster algorithm for DrudeSCFIntegrator (#4354)
Peter Eastman
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about 1 year ago
Fixed bug in large blocks optimization with triclinic boxes (#4351)
Peter Eastman
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about 1 year ago
Use portable SIMD vectors as a backup (#4328)
Peter Eastman
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about 1 year ago
Merged more code into common platform (#4346)
Peter Eastman
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about 1 year ago
Improved sorting of blocks when building neighbor list (#4343)
Peter Eastman
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about 1 year ago
Added CustomCentroidBondForce.addTabulatedFunction to STEAL_OWNERSHIP table in Python wrapper configuration script (#4340)
Evan Pretti
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about 1 year ago
Enable SSE code for LBFGS (#4327)
Peter Eastman
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about 1 year ago
Optimizations to reporters (#4330)
Peter Eastman
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about 1 year ago
Preserve bond type and order in all `Modeller` operations (#4323)
Nicola De Mitri 2
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about 1 year ago
Fixes to Python API for ATMForce (#4319)
Peter Eastman
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about 1 year ago
Serialization proxy for ATMForce did not record the particles (#4317)
Peter Eastman
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about 1 year ago
Fixed some incorrect comments (#4294)
Peter Eastman
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about 1 year ago
addExtraParticles() handles LocalCoordinatesSites with more than three particles (#4293)
Peter Eastman
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about 1 year ago
Clarified documentation on virtual sites (#4292)
Peter Eastman
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about 1 year ago
Fixed list of solvent types in manual (#4291)
Peter Eastman
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about 1 year ago
Fixed errors in generating Python docstrings (#4290)
Peter Eastman
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about 1 year ago
Fix CI deprecation warnings (#4282)
bdenhollander
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about 1 year ago
Remove OpenCL cl_khr_fp64 pragma no longer required in OpenCL 1.2 (#4289)
bdenhollander
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about 1 year ago
Removed use of obsolete method iteritems() (#4285)
Peter Eastman
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about 1 year ago
Enable flush after enqueueReadBuffer on Windows (#3973)
bdenhollander
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about 1 year ago
Fixed test failure (#4281)
Peter Eastman
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about 1 year ago
Fixed issues in applying patches (#4279)
Peter Eastman
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about 1 year ago
fix time unit for XTCFile (#4271)
Zheng GONG
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about 1 year ago
WIP - looking for a way to optimise performance of creating contexts by removing temporary arrays (and their associated mallocs/frees) (#4261)
Christopher Woods
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about 1 year ago
Fix exclusion tiles sorting on AMD GCN/CDNA (64 threads per wave) (#4268)
Anton Gorenko
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about 1 year ago
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