Sorry, didn't know where to 'open an issue'.
On p51., where it says *ff99SB*, it should say *ff19SB*.
A recent addition to AMBER family of protein force fields, *ff99SB*[19],
was developed
without an inherent bias towards a water model; OPC is recommended for use
with this force field[19].
...
[19] C. Tian; K. Kasavajhala; K. Belfon; L. Raguette; H. Huang; A. Migues;
J. Bickel; Y. Wang; J. Pin-
cay; Q. Wu; C. Simmerling. ff19SB: Amino-Acid-Specific Protein Backbone
Parameters Trained against
Quantum Mechanics Energy Surfaces in Solution. J. Chem. Theory Comput.,
2020, 16, 528–552.
Cheers,
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Jul 06 2023 - 01:00:02 PDT
