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Merge branch 'patch-3' of github.com:evoyiatzis/lammps into collected-small-changes

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Axel Kohlmeyer
2020-10-14 15:18:03 -04:00
parent 865b159d16 45939602a5
commit 3926cbe5f0
1 changed files with 0 additions and 5 deletions
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doc/src/fix_widom.rst
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@ -86,11 +86,6 @@ molecule file. See the :doc:`molecule <molecule>` command for details.
The only settings required to be in this file are the coordinates and The only settings required to be in this file are the coordinates and
types of atoms in the molecule. types of atoms in the molecule.
If you wish to insert molecules via the *mol* keyword, that will have
their bonds or angles constrained via SHAKE, use the *shake* keyword,
specifying as its value the ID of a separate :doc:`fix shake
<fix_shake>` command which also appears in your input script.
Note that fix widom does not use configurational bias MC or any other Note that fix widom does not use configurational bias MC or any other
kind of sampling of intramolecular degrees of freedom. Inserted kind of sampling of intramolecular degrees of freedom. Inserted
molecules can have different orientations, but they will all have the molecules can have different orientations, but they will all have the