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| | [No title] |
 | | While any information regarding a set of parameters (bond, angle, torsion, out-of-plane,charges,van der Waals, etc) would be welcome, we are interested in generating the neccesary parameters, and in a form suitable for use in CHARMM. |
 | | Please note, however, that this is only an approximate procedure since it ignors the interactions between parameters of different types and it is not the method used in standard parameterisations. |
 | | van der Waals parameters could be obtained by analogy (for example using the normal carbonyl O parameters for the nitro O). |
| amber.scripps.edu /0Net/parameters (2335 words) |
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