1.x

Issues

• How to forbid transition in a multiple state TPS network?

  openpathsampling/openpathsampling#692 · Filter by author sroet opened on Jul 13, 2017 · 1.x
  2

  

• CV File external engine

  onhold
  Unread
  openpathsampling/openpathsampling#626·dwhswenson opened Nov 6, 2016 · Updated Jan 17, 2017
  2

• Test cleanup

  openpathsampling/openpathsampling#590 · Filter by author dwhswenson opened on Sep 22, 2016 · 1.x
  1

• Adaptively determining weights for single-replica methods

  noturgent
  openpathsampling/openpathsampling#524 · Filter by author jchodera opened on Jul 24, 2016 · 1.x
  1

• Allow storage of references to externally stored trajectory frames

  enhancement
  openpathsampling/openpathsampling#519 · Filter by author jhprinz opened on Jul 13, 2016 · 1.x
  1

  

• [WIP] A simple MSM engine

  onhold
  Unread
  openpathsampling/openpathsampling#518·jhprinz opened Jul 11, 2016 · Updated Jun 18, 2018
  3

• [WIP] Lammps support

  onhold
  Unread
  openpathsampling/openpathsampling#319·jhprinz opened Oct 5, 2015 · Updated Nov 7, 2016
  12

• Gromacs and Lammps and CP2K support

  enhancement
  openpathsampling/openpathsampling#312 · Filter by author jhprinz opened on Sep 18, 2015 · 1.x
  12

• [WIP] Parallel committor with Dask

  experimentalfeature
  Unread
  openpathsampling/openpathsampling#1001·dwhswenson opened Apr 6, 2021 · Updated Dec 7, 2021