- Timestamp:
- 11/19/09 11:29:16 (14 years ago)
- Branches:
- master
- Children:
- 2d5d396
- Parents:
- ffd2d46
- File:
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- 1 edited
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mklist.f
rffd2d46 rcb47b9c 19 19 ! TODO: Calculate van-der-Waals regions over all molecules. 20 20 include 'INCL.H' 21 21 integer nml 22 23 integer mxh, mx2, l1st1, l1st2, l2nd1, l2nd2, l1i, l2i 22 24 parameter (mxh=50, ! max. # of atom regions 23 25 & mx2=50) … … 27 29 dimension l1st1(mxh),l1st2(mxh),l2nd1(mxh),l2nd2(mxh) 28 30 & ,l1i(mxbd),l2i(mx2) 31 32 integer ia, i, i1s, i2s, ibd, ib, ifivr, ifiat, ilaat, im, ilavr, 33 & iob, io, ioiob, iow, it, is, iv, jbd, j, n1i, n14, n1st, 34 & n2nd, n2i, ntlms, nvw 29 35 30 36 ! _______________________ indices of 1st vdw-region/14-partner for 'nml'
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