[gmx-users] what's the math algorithm?
liu4gre at gmail.com
Thu Nov 17 21:29:27 CET 2011
Assuming I have a some tabulated potentials, table.xvg, tablep.xvg,
table_P_P.xvg, table_P_C.xvg and so on.
Also there are non-zero values in the first column of both table.xvg and
tablep.xvg; while the first column (x), the six column (h(x)) and the last
column (h'(x)) have non-zero numbers.
All other columns have only 0. So what's the math behind it? Thanks.
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