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Unverified Commit 309e19f9 authored by Michele Invernizzi's avatar Michele Invernizzi Committed by GitHub
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OPES_METAD cleanup (#672)

* using plumed_massert

* added SIGMA_MIN

* regtest for NLIST and SIGMA_MIN

* check that all walkers read the same file when restarting

* various cleanup

* adjusting inline

* dump state after adding kernel

* added error for too small STATE_WSTRIDE

* better log for adaptive SIGMA

* minor

* check and avoid extremely small adaptive sigmas

* wrong logic

* rescaling height also for adaptive sigma and better handling of extremely small adaptive sigma

* allow for conversion from kernels to state

* added OPES_METAD tutorial

* small fixes

* better metad reweighting disclaimer

* adjust kbt and some other minor things

* typo

* cleanup
parent 5b1dd51d
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