CV:NASBO: Difference between revisions

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The simple base pair opening for the A:B base pair. This is an earlier implementation providing only opening, full set of simple base pair parameters is availble via [[CV:NASPP]].   
The simple base pair opening for the A:B base pair. This is an earlier implementation providing only opening, full set of simple base pair parameters is availble via [[CV:NASPP]].   


'''IMPORTANT:''' It is critical that the A and B bases are not separated during simulation due to imaging of DNA chains into the simulation box. Use either topjoinmol from CATs or use the correct value of iwrap in sander or pmemd.
'''IMPORTANT:''' It is critical that the A and B bases are not separated during simulation due to imaging of DNA chains into the simulation box. Use ether topjoinmol from CATs to merge both chains into a single molecule or use the correct value of iwrap in sander or pmemd.


===Specification===
===Specification===