| commit | 4555ffbeb193da3c127b5a2ac8e852ce5967e393 | |
| author | Christian Blau <cblau.mail@gmail.com> | |
| Thu, 1 Oct 2020 11:52:26 +0000 (1 11:52 +0000) | ||
| committer | Joe Jordan <ejjordan12@gmail.com> | |
| Thu, 1 Oct 2020 11:52:26 +0000 (1 11:52 +0000) | ||
| tree | 6d722f299b569464fd43bcc7f6bea2f0145eb791 | treesnapshot (tar.gz zip) |
| parent | 4b3f1386cae66f94bddb5f14287b9080eceab2fb | commitdiff |
Fix the FEP lambda interpolation
Setting any lambda array, initial lambda or state != 0, the
interpolated lambda values were wrongly interpolated. This
patch fixes this behaviour.
Setting any lambda array, initial lambda or state != 0, the
interpolated lambda values were wrongly interpolated. This
patch fixes this behaviour.
| src/gromacs/mdlib/md_support.cpp | diffblobblamehistory |