Releases: UCL-CCS/TIES_MD
Releases · UCL-CCS/TIES_MD
Minor: improving analysis and tests
07 Oct 13:01
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Add more complete analysis with documentation 36237bb
Move tests to tmp dir (Helps with file writing in Conda CI) 3be63e5
Improvments for ORNL Crusher
06 Sep 15:39
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Mainly to allow running on Crusher with OpenCL. 3e40114
Allow parallelism over alchemical windows in NAMD. 4696c58
Increasing test coverage. 28b4fa2
Publish API and documentation
09 Aug 13:04
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Adds complete implementation for API with associated docs. 9f0363b
Apply fixes to run on Summit ORNL 3e857c0
Move to newest version of PyMBAR 497bcd8
Simplifies integrations with TIES20.
Conda-forge release
02 Aug 10:08
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Combine TIES_MD and TIES_analysis
14 Jun 08:21
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v1.2
make node_ids ints in docs
First release
09 Jun 10:08
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