I am working on solving the solution structure of an 8 base-pair self-complementary DNA duplex. I tried using the distance symmetry restraints as outlined on
page 280 in volume 3.1. However, I could not generate the energy violation fileat the end of the MD/SA protocol. This was due to the termination error:
"%NOEPRI-ERR: PRINt not possible with POTEntial set to SYMM, HIGH, or 3DPO".
Is there another way of generating this file without using the print statement?
Irene Zegar
irene zegar
