Molecule

E

(flat bilayer)

kcal/mol

E

(hydroxy pore)

kcal/mol

E

(enhancement)

kcal/mol

TNT

17.9

42.3

24.4

DADNE

14.4

22.5

8.1

CL-20

14.9

38.3

23.4

DNT

15.5

35.3

19.8

HMX

15.1

37.3

22.2

HNS

24.7

32.3

7.6

NTO

11.2

20.5

9.3

PETN

14.7

35.2

20.5

RDX

7.2

21.5

14.3

TATB

24.5

51.5

27.0

TNB

23.7

53.5

29.8

TNR

19.2

44.3

25.1

BDNFA

15.9

33.4

17.5

BTTN

14.2

27.0

12.8

EGDN

10.8

20.7

9.9

K10A

17.3

27.2

9.9

K10B

19.5

48.5

29.0

MTN

12.7

34.6

21.9

NIMMO

10.2

24.4

14.2

NG

11.8

37.3

25.5

Tetryl

15.5

32.7

17.2

TNAZ

17.2

23.6

6.4