Hi, I'm new to OpenMM. Could someone help on adding distance constrain between the mass centers of two molecules? e.g.
f= k(r-ro)^a, r>r0
f=0,r<=r0
r is the distance between the centers of two molecules.
How should define the external force in openmm?
Thank you very much!
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- Tue Nov 29, 2022 9:11 am
- Forum: OpenMM
- Topic: adding distance constrain between the centers of two molecules
- Replies: 2
- Views: 298