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Copy path26B.frcmod
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26B.frcmod
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MASS
BOND
ANGLE
DIHE
ns-c -ca-ca 4 8.490 180.000 2.000 same as n -c -ca-ca, penalty score= 0.0
o -c -ns-c3 4 10.000 180.000 2.000 same as X -c -n -X , penalty score= 0.0
ca-ca-ns-hn 4 1.800 180.000 2.000 same as X -ca-n -X , penalty score= 0.0
o -c -ns-ca 4 10.000 180.000 2.000 same as X -c -n -X , penalty score= 0.0
ns-c -ns-ca 4 10.000 180.000 2.000 same as X -c -n -X , penalty score= 0.0
ns-c -ns-hn 4 10.000 180.000 2.000 same as X -c -n -X , penalty score= 0.0
o -c -ns-hn 1 2.500 180.000 -2.000 same as o -c -n -hn
o -c -ns-hn 1 2.000 0.000 1.000 same as o -c -n -hn, penalty score= 0.0
c -c3-ns-hn 6 0.000 0.000 2.000 same as X -c3-n -X , penalty score= 0.0
c3-c3-ns-hn 6 0.000 0.000 2.000 same as X -c3-n -X , penalty score= 0.0
h1-c3-ns-hn 6 0.000 0.000 2.000 same as X -c3-n -X , penalty score= 0.0
ca-c -ns-hn 4 10.000 180.000 2.000 same as X -c -n -X , penalty score= 0.0
IMPROPER
c -c3-ns-hn 1.1 180.0 2.0 Same as X -X -n -hn, penalty score= 6.0 (use general term))
c3-o -c -o 1.1 180.0 2.0 Using general improper torsional angle X- o- c- o, penalty score= 3.0)
ca-ns-c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 6.0)
c -ca-ca-ca 1.1 180.0 2.0 Using the default value
ca-ca-ca-ha 1.1 180.0 2.0 Using general improper torsional angle X- X-ca-ha, penalty score= 6.0)
ca-ca-ca-ca 1.1 180.0 2.0 Using the default value
ca-ca-ca-ns 1.1 180.0 2.0 Using the default value
c -ca-ns-hn 1.1 180.0 2.0 Same as X -X -n -hn, penalty score= 6.0 (use general term))
ns-ns-c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 6.0)
NONBON