Hello!
I would like to introduce Lennard-Jones potentials between two different
sets of atoms ((1) all HETATMS and (2) all protein atoms in a 7 A
environment shell around the HETATMs).
Which commands do I have to include into the top file to do this?
Thank you in advance for your answer,
Andreas
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# Andreas Evers #
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# Research group for Drug Design & X-ray Crystallography #
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