Differences

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--- options:main [2018/09/23 10:56] – daniel
+++ options:main [2019/10/08 18:07] – [uq] daniel
@@ Line 7: / Line 7: @@
 ^  General options  ^^
+| [[#bindist|bindist]] | Enable writing the binning distribution file |
 | [[#contrib|contrib]] | Enable [[config:bocp|Box of Contributing Particles]] |
-| [[#dist|dist]] | Enable writing the radial distribution file |
 | [[#dsf|dsf]] | Enable the damped shift force approach |
 | [[#evo|evo]] | Enable evolutionary optimization algorithm |
@@ Line 16: / Line 16: @@
 | [[#resc|resc]] | Enable rescaling of tabulated potentials |
 | [[#stress|stress]] | Add stress in optimization target |
+| [[#uq|uq]] | Generate potential ensemble for uncertainty quantification |
 [[#deprecated options|Deprecated options]]
@@ Line 22: / Line 23: @@
 ===== General options =====
+==== bindist ====
+Create a [[output:bindistfile|binning distribution file]] from the provided atomic configurations. This feature is only supported for tabulated potentials.
+Use this command line switch during the './waf configure' stage to enable the dist feature:
+<code>--enable-bindist</code>
 ==== contrib ====
@@ Line 29: / Line 37: @@
 Use this command line switch during the './waf configure' stage to enable the contrib feature:
 <code>--enable-contrib</code>
-==== dist ====
-Create a [[:distfile|radial distribution file]] from the provided atomic configurations.
-Use this command line switch during the './waf configure' stage to enable the dist feature:
-<code>--enable-dist</code>
 ==== dsf ====
@@ Line 61: / Line 62: @@
 ==== mpi ====
-Enable [[:mpi|MPI parallelization]] for force calculations.
+Enable [[running:mpi|MPI parallelization]] for force calculations.
 Use this command line switch during the './waf configure' stage to enable the MPI feature:
@@ Line 86: / Line 87: @@
 Use this command line switch during the './waf configure' stage to enable the stress feature:
 <code>--enable-stress</code>
+==== uq ====
+Generate potential ensemble for [[uq|uncertainty quantification]].
+Use this command line switch during the './waf configure' stage to enable the stress feature:
+<code>--enable-uq</code>
 -----
-=====  Deprecated Options in the Compilation Target  =====
+===== Deprecated Options =====
-The following options have been removed from potfit and are no longer supported.
+The following options have been removed from //potfit// and are no longer supported.
   * limit