44 Commits (master)
 

Author SHA1 Message Date
  Peter Colberg 6e4b9d7bea Compute cylindrical velocity field on OpenCL device 1 year ago
  Peter Colberg 40e82ddcb9 Compute polar density function on OpenCL device 1 year ago
  Peter Colberg fde15b178e Compute cylindrical density function on OpenCL device 1 year ago
  Peter Colberg 27897291e8 Fix sampling of correlation functions for nonzero initial step 1 year ago
  Peter Colberg c335490d0c Fix buffer datatype for Hilbert curve tests 1 year ago
  Peter Colberg c314a525cb Allow overriding principal dimension of Hilbert curve 1 year ago
  Peter Colberg f258835c95 Use default matplotlib renderer 1 year ago
  Peter Colberg 798fe83d2a Use mathtext syntax in axis labels 1 year ago
  Peter Colberg aefc77338d Fix matplotlib deprecation warning for version 1.5 1 year ago
  Peter Colberg 72c99bfb35 Fix energy drift for different CA and CB potentials 1 year ago
  Peter Colberg 8b9e34f0f2 Use full name for H5MD file author 1 year ago
  Peter Colberg c5183630a8 Fix spelling of “Ångström” 3 years ago
  Peter Colberg a8095a660c Cite Nanoconfined catalytic Ångström-size motors 3 years ago
  Peter Colberg e3a962e5d9 Fix potential integer overflow 3 years ago
  Peter Colberg 442dda6a57 Cite H5MD 3 years ago
  Peter Colberg 62b10b26d4 Round number of bins for non-even edge lengths 3 years ago
  Peter Colberg 7b664e24c9 Reduce trajectory interval with single dimer 3 years ago
  Peter Colberg cf2c6f73a9 Link to tracing JIT compilation 3 years ago
  Peter Colberg d0dfbfcf6f Plot dimer position perpendicular to walls 3 years ago
  Peter Colberg 542e33ee50 Support loading configuration into existing table 3 years ago
  Peter Colberg f429924945 Check step after integration 3 years ago
  Peter Colberg 32889a583b Remove forces from domain snapshot 3 years ago
  Peter Colberg 482956a93d Fix snapshot file datatype for solvent images 3 years ago
  Peter Colberg ae48ca4102 Avoid unneeded snapshot at final step 3 years ago
  Peter Colberg a13c9337d6 Support varying final step for observables 3 years ago
  Peter Colberg 4a7ecb15d4 Avoid allocation of host memory to initialise device buffers 3 years ago
  Peter Colberg 9aa0a04c17 Set minimum chunk size to 8 KB for scalar observables 3 years ago
  Peter Colberg c146fad8a6 Explicitly close all HDF5 objects 3 years ago
  Peter Colberg 59a03c64e1 Fix writing thermodynamic variables with single precision 3 years ago
  Peter Colberg c7a464ecee Write initial snapshot after interval 3 years ago
  Peter Colberg c396a7478e Fix use of uninitialised value 3 years ago
  Peter Colberg a5a5416c39 Fix detection of OpenCL device version 3 years ago
  Peter Colberg ef79982f24 Add release notes 3 years ago
  Peter Colberg f1c95a07ec Write user's guide 3 years ago
  Peter Colberg fb16488073 Write installation guide 3 years ago
  Peter Colberg b732ed0471 Summarise project 3 years ago
  Peter Colberg d0d88f1f73 Add top-level makefile 3 years ago
  Peter Colberg f41047d65d Document linking hilbert test program 3 years ago
  Peter Colberg 17c0657514 Color line segments of Hilbert curve 3 years ago
  Peter Colberg c0de740f3c Sample solvent at final step only 3 years ago
  Peter Colberg 2bec0bdea4 Limit HDF5 dataset chunk size to 1 MiB 3 years ago
  Peter Colberg 6e897ed8ea Avoid side effects in neighbour list checks 3 years ago
  Peter Colberg 9a70b76e8d Close all open objects before closing HDF5 file 3 years ago
  Peter Colberg bea321289a Initialise Ångström-scale chemically powered sphere-dimer motor 3 years ago