Closed xiki-tempula closed 1 year ago
for pymbar 4, MBAR(method='robust') will give the same iterative solver as the current autombar, so autombar should be Deprecate in alchemlyb2 where we introduce pymbar 4.
ok, we'll add it to 1.0.1 #279
Actually, let's just remove AutoMBAR from alchemlyb 2.0.
We keep in 1.x but it's not needed for 2.0.
for pymbar 4, MBAR(method='robust') will give the same iterative solver as the current autombar, so autombar should be Deprecate in alchemlyb2 where we introduce pymbar 4.