Loading lib/qmmm/README +1 −3 Original line number Diff line number Diff line Loading @@ -32,9 +32,7 @@ and 4 manually, as outlined below. WARNING: This is experimental code under developement and is provided at this early stage to encourage others to write interfaces to other QM codes. Please test *very* carefully before using this software for production calculations. At the time of the last update of this README (July 2016) you have to download a QE snapshot (revision 12611) from the QE subversion repository. production calculations. At this point, both mechanical and multipole based electrostatic coupling have been successfully tested on a cluster of water Loading Loading
lib/qmmm/README +1 −3 Original line number Diff line number Diff line Loading @@ -32,9 +32,7 @@ and 4 manually, as outlined below. WARNING: This is experimental code under developement and is provided at this early stage to encourage others to write interfaces to other QM codes. Please test *very* carefully before using this software for production calculations. At the time of the last update of this README (July 2016) you have to download a QE snapshot (revision 12611) from the QE subversion repository. production calculations. At this point, both mechanical and multipole based electrostatic coupling have been successfully tested on a cluster of water Loading
