Correct. If you have 1-3 interactions to turn off (and most force fields typically include those), you’d use “0.0 0.0 1.0” instead, and so on.
—AEI
Correct. If you have 1-3 interactions to turn off (and most force fields typically include those), you’d use “0.0 0.0 1.0” instead, and so on.
—AEI