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Author
2013-10-08
Fixing bugs reading data.
Magnus Lundborg
2013-10-04
Improved examples.
Magnus Lundborg
2013-08-22
Submit char instead of tng_data_type from examples.
Magnus Lundborg
2013-08-20
Use char instead of enum to avoid endianness problems
Magnus Lundborg
2013-06-25
Added test of utility opening and closing.
Magnus Lundborg
2013-05-29
Improved documentation
Magnus Lundborg
2013-05-29
Fix utility function for box shape reading.
Magnus Lundborg
2013-05-29
Increase number of particles again in example.
Magnus Lundborg
2013-05-28
Fixed error where velocities were trashed.
Magnus Lundborg
2013-05-25
Added debugging code to locate where velocities get trashed.
Daniel Spangberg
2013-05-25
Add more tests for compression of frames that contain only zero
Daniel Spangberg
2013-05-24
Improved utility functions. Bug fixes.
Magnus Lundborg
2013-05-23
More work on high-level API. New example files.
Magnus Lundborg
2013-05-22
New functions added (mainly utility functions).
Magnus Lundborg
2013-05-22
Added building options and bin subdirectories
Magnus Lundborg
2013-05-17
Fix errors introduced when doing if(UNIX) in CMakeLists.txt
Daniel Spangberg
2013-05-17
Only add math library on UNIX. Copy .sh files on UNIX. Copy .bat files on win...
Daniel Spangberg
2013-05-17
Updated number of tests in test suite scripts for tng compress.
Daniel Spangberg
2013-05-17
Added conversion from unpacked integers to float/double.
Daniel Spangberg
2013-05-16
Several changes to get the compression testsuite working for recompression te...
Daniel Spangberg
2013-05-16
Properly compile the tng_compress testsuite using cmake.
Daniel Spangberg
2013-05-16
Moved include file template from src to include.
Magnus Lundborg
2013-05-15
Fix linking with math library
Daniel Spangberg
2013-05-15
fix testsuite.sh script.
Daniel Spangberg
2013-05-15
Also add the modified cmakefiles.
Daniel Spangberg
2013-05-15
Added tng_compress trajectory compression algorithms
Daniel Spangberg
2013-04-26
Increase the simulation length and reduce number of particles to get more mov...
Magnus Lundborg
2013-04-18
Add tng_num_frames_get() to get the number of frames in the trajectory. Added...
Magnus Lundborg
2013-03-19
If inttypes is not found (Visual Studio) some typedefs and defines need to be...
Magnus Lundborg
2013-03-13
Add gzip compression and uncompression to master branch.
Magnus Lundborg
2013-03-12
Finalize last written frame set when destroying trajectory. Fix bug reading d...
Magnus Lundborg
2013-02-11
Remove omp header stubs
Magnus Lundborg
2013-02-08
Add a standard block ID for partial charges.
Magnus Lundborg
2013-01-30
Fix bug in chain_name_of_particle_get
Magnus Lundborg
2013-01-28
Increase number of particles in md example.
Magnus Lundborg
2013-01-24
Fix copyright notice. In practice reverting commit 75505b10abc097c123c427b5df...
Magnus Lundborg
2013-01-23
Minor updates in copyright notice. Fixes in documentation index page.
Magnus Lundborg
2013-01-23
Updated copyright notice.
Magnus Lundborg
2013-01-22
Minor fixes in mdrun C example. Make mdrun fortran example save data sparsely...
Magnus Lundborg
2013-01-21
Fix bugs related to sparse data. Write sparse data in md_openmp (C version).
Magnus Lundborg
2013-01-21
Include licence info.
Magnus Lundborg
2013-01-18
Write annotations block in test write/read.
Magnus Lundborg
2013-01-18
Write partial charges in test write/read
Magnus Lundborg
2013-01-18
Fix bug in test read/write file (not writing frame sets). Write box shape in ...
Magnus Lundborg
2013-01-16
Minor name fixes
Magnus Lundborg
2013-01-15
Fixed bug in tng_current_frame_set_get. Improved parallel reading example.
Magnus Lundborg
2013-01-15
Test parallel i/o (not very quick atm).
Magnus Lundborg
2013-01-14
Added functions to get residue and chain names from atom number.
Magnus Lundborg
2013-01-14
Added functions to get atom names and molecule names from atom number. Fixed ...
Magnus Lundborg
2013-01-11
Fix text output
Magnus Lundborg
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