-
3
-
-
0000090597
-
-
(b) Drakenberg, T.; Dahlqvist, K. J.; Forsen, S. J. Phys. Chem. 1972, 76, 2178-2183.
-
(1972)
J. Phys. Chem.
, vol.76
, pp. 2178-2183
-
-
Drakenberg, T.1
Dahlqvist, K.J.2
Forsen, S.3
-
4
-
-
0030939835
-
-
(a) Cox, C.; Young, V. G., Jr.; Lectka, T. J. Am. Chem. Soc. 1997, 119, 2307-2308.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 2307-2308
-
-
Cox, C.1
Young V.G., Jr.2
Lectka, T.3
-
5
-
-
0030008366
-
-
(b) Cox, C.; Ferraris, D.; Murthy, N. N.; Lectka, T. J. Am. Chem. Soc. 1996, 118, 5332-5333.
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 5332-5333
-
-
Cox, C.1
Ferraris, D.2
Murthy, N.N.3
Lectka, T.4
-
7
-
-
0041836665
-
-
For example: Neugebauer Crawford, S. M.; Taha, A. N.; True, N. S.; LeMaster, C. B. J. Phys. Chem. A 1997, 101, 4699-4706.
-
(1997)
J. Phys. Chem. A
, vol.101
, pp. 4699-4706
-
-
Neugebauer Crawford, S.M.1
Taha, A.N.2
True, N.S.3
LeMaster, C.B.4
-
8
-
-
0001340839
-
-
Creighton, T. E., Ed.; W. H. Freeman: New York
-
(a) Schmid, F. X. In Protein Folding; Creighton, T. E., Ed.; W. H. Freeman: New York, 1992; pp 197-241, see also other chapters in this book.
-
(1992)
Protein Folding
, pp. 197-241
-
-
Schmid, F.X.1
-
9
-
-
0027816998
-
-
(b) Schmid, F. X.; Mayr, L. M.; Mücke, M.; Schönbrunner, E. R. Adv. Protein Chem. 1993, 44, 25-66.
-
(1993)
Adv. Protein Chem.
, vol.44
, pp. 25-66
-
-
Schmid, F.X.1
Mayr, L.M.2
Mücke, M.3
Schönbrunner, E.R.4
-
10
-
-
0000535768
-
-
and references therein
-
(c) Eberhardt, E. S.; Loh, S. N.; Hinck, A. P.; Raines, R. T. J. Am. Chem. Soc. 1992, 114, 5437-5439 and references therein.
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 5437-5439
-
-
Eberhardt, E.S.1
Loh, S.N.2
Hinck, A.P.3
Raines, R.T.4
-
12
-
-
0026030568
-
-
(a) Schreiber, S. L. Science 1991, 251, 283-287.
-
(1991)
Science
, vol.251
, pp. 283-287
-
-
Schreiber, S.L.1
-
17
-
-
0027996432
-
-
(a) Gould, I. R.; Cornell, W. D.; Hillier, I. H. J. Am. Chem. Soc. 1994, 116, 9250-9256.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 9250-9256
-
-
Gould, I.R.1
Cornell, W.D.2
Hillier, I.H.3
-
18
-
-
0030573108
-
-
(b) Adamo, C.; Dillet, V.; Barone, V. Chem. Phys. Lett. 1996, 263, 113-118.
-
(1996)
Chem. Phys. Lett.
, vol.263
, pp. 113-118
-
-
Adamo, C.1
Dillet, V.2
Barone, V.3
-
19
-
-
0030815020
-
-
(c) Pierce, A. C.; Jorgensen, W. L. Angew. Chem., Int. Ed. Engl. 1997, 36, 1466-1469.
-
(1997)
Angew. Chem., Int. Ed. Engl.
, vol.36
, pp. 1466-1469
-
-
Pierce, A.C.1
Jorgensen, W.L.2
-
20
-
-
0030078277
-
-
(d) Rao, B. G.; Kim, E. E.; Murcko, M. A. J. Comput.-Aid. Mol. Des. 1996, 10, 23.
-
(1996)
J. Comput.-Aid. Mol. Des.
, vol.10
, pp. 23
-
-
Rao, B.G.1
Kim, E.E.2
Murcko, M.A.3
-
21
-
-
0028077861
-
-
(e) Yang, B.; Wright, J.; Eldefrawi, M. E.; Pou, S.; MacKerell, A. D., Jr. J. Am. Chem. Soc. 1994, 116, 8722-8732.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 8722-8732
-
-
Yang, B.1
Wright, J.2
Eldefrawi, M.E.3
Pou, S.4
MacKerell A.D., Jr.5
-
23
-
-
0031576673
-
-
(g) Urban, J. J.; Cronin, C. W.; Roberts, R. R.; Famini, G. R. J. Am. Chem. Soc. 1997, 119, 12292-12299.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 12292-12299
-
-
Urban, J.J.1
Cronin, C.W.2
Roberts, R.R.3
Famini, G.R.4
-
24
-
-
11744256643
-
-
For reviews of continuum solvation models, see: (a) Tomasi, J.; Persico, M. Chem. Rev. 1994, 94, 2027-2094. (b) Cramer, C. J.; Truhlar, D. G. Rev. Comput. Chem. 1990, 6, 1-72.
-
(1994)
Chem. Rev.
, vol.94
, pp. 2027-2094
-
-
Tomasi, J.1
Persico, M.2
-
25
-
-
11744256643
-
-
For reviews of continuum solvation models, see: (a) Tomasi, J.; Persico, M. Chem. Rev. 1994, 94, 2027-2094. (b) Cramer, C. J.; Truhlar, D. G. Rev. Comput. Chem. 1990, 6, 1-72.
-
(1990)
Rev. Comput. Chem.
, vol.6
, pp. 1-72
-
-
Cramer, C.J.1
Truhlar, D.G.2
-
26
-
-
84961979198
-
-
and references therein
-
(a) Mennucci, B.; Tomasi, J. J. Chem. Phys. 1997, 106, 5151-5158 and references therein.
-
(1997)
J. Chem. Phys.
, vol.106
, pp. 5151-5158
-
-
Mennucci, B.1
Tomasi, J.2
-
27
-
-
84946893847
-
-
(b) Miertus, S.; Scrocco, E.; Tomasi, J. Chem. Phys. 1981, 55, 117-129.
-
(1981)
Chem. Phys.
, vol.55
, pp. 117-129
-
-
Miertus, S.1
Scrocco, E.2
Tomasi, J.3
-
28
-
-
84962469196
-
-
(c)Tomasi, J.; Bonaccorsi, R.; Cammi, R.; Valle, F. O. J. J. Mol. Struct. 1991, 234, 401.
-
(1991)
J. Mol. Struct.
, vol.234
, pp. 401
-
-
Tomasi, J.1
Bonaccorsi, R.2
Cammi, R.3
Valle, F.O.J.4
-
29
-
-
1542356431
-
-
Foresman, J.; Keith, T. A.; Wiberg, K. B.; Snoonian, J.; Frisch, M. J. Phys. Chem. 1996, 100, 16098-16104.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 16098-16104
-
-
Foresman, J.1
Keith, T.A.2
Wiberg, K.B.3
Snoonian, J.4
Frisch, M.5
-
34
-
-
0000328094
-
-
Truong, T. N.; Stefanovich, E. V. J. Phys. Chem. 1995, 99, 14700-14706. Truong, T. N.; Truong, T.-T. T.; Stefanovich, E. V. J. Phys. Chem. 1997, 107, 11881-1889.
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 14700-14706
-
-
Truong, T.N.1
Stefanovich, E.V.2
-
35
-
-
0000328094
-
-
Truong, T. N.; Stefanovich, E. V. J. Phys. Chem. 1995, 99, 14700- 14706. Truong, T. N.; Truong, T.-T. T.; Stefanovich, E. V. J. Phys. Chem. 1997, 107, 11881-1889.
-
(1997)
J. Phys. Chem.
, vol.107
, pp. 11881-11889
-
-
Truong, T.N.1
Truong, T.-T.T.2
Stefanovich, E.V.3
-
36
-
-
0030180875
-
-
Marten, B.; Kim, K.; Cortis, C.; Friesner, R. A.; Murphy, R. B.; Ringnalda, M. N.; Sitkoff, D.; Honig, B. J. Phys. Chem. 1996, 100, 11775-11788.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 11775-11788
-
-
Marten, B.1
Kim, K.2
Cortis, C.3
Friesner, R.A.4
Murphy, R.B.5
Ringnalda, M.N.6
Sitkoff, D.7
Honig, B.8
-
38
-
-
0038955693
-
-
Bader, J. S.; Cortis, C. M.; Berne, B. J. J. Chem. Phys. 1997, 106, 2372-2387.
-
(1997)
J. Chem. Phys.
, vol.106
, pp. 2372-2387
-
-
Bader, J.S.1
Cortis, C.M.2
Berne, B.J.3
-
39
-
-
0001267117
-
-
Giesen, D. J.; Gu, M. Z.; Cramer, C. J.; Truhlar, D. G. J. Org. Chem. 1996, 61, 8720-8721. Chambers, C. C.; Hawkins, G. D.; Cramer, C. J.; Truhlar, D. G. J. Phys. Chem. 1996, 100, 16385-16398.
-
(1996)
J. Org. Chem.
, vol.61
, pp. 8720-8721
-
-
Giesen, D.J.1
Gu, M.Z.2
Cramer, C.J.3
Truhlar, D.G.4
-
40
-
-
33748905333
-
-
Giesen, D. J.; Gu, M. Z.; Cramer, C. J.; Truhlar, D. G. J. Org. Chem. 1996, 61, 8720-8721. Chambers, C. C.; Hawkins, G. D.; Cramer, C. J.; Truhlar, D. G. J. Phys. Chem. 1996, 100, 16385-16398.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 16385-16398
-
-
Chambers, C.C.1
Hawkins, G.D.2
Cramer, C.J.3
Truhlar, D.G.4
-
41
-
-
0030774472
-
-
Hummer, G.; Pratt, L. R.; García, A. E. J. Am. Chem. Soc. 1997, 119, 8523-8527.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 8523-8527
-
-
Hummer, G.1
Pratt, L.R.2
García, A.E.3
-
42
-
-
0344778061
-
-
Still, W. C.; Tempczyk, A.; Hawley, R. C.; Hendrickson, T. J. Am. Chem. Soc. 1990, 112, 6127-6129.
-
(1990)
J. Am. Chem. Soc.
, vol.112
, pp. 6127-6129
-
-
Still, W.C.1
Tempczyk, A.2
Hawley, R.C.3
Hendrickson, T.4
-
43
-
-
0032506975
-
-
(a) Perrin, C. L.; Fabian, M. A.; Rivero, I. A. J. Am. Chem. Soc. 1998, 120, 1044-1047.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 1044-1047
-
-
Perrin, C.L.1
Fabian, M.A.2
Rivero, I.A.3
-
45
-
-
0542430115
-
-
(c) Wong, M. W.; Wiberg, K. B.; Frisch, M. J. J. Am. Chem. Soc. 1992, 114, 1645-1652.
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 1645-1652
-
-
Wong, M.W.1
Wiberg, K.B.2
Frisch, M.J.3
-
48
-
-
0041403695
-
-
(f) Jorgensen, W. L.; Morales de Tirado, P. I.; Severance, D. L. J. Am. Chem. Soc. 1994, 116, 2199-2200.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 2199-2200
-
-
Jorgensen, W.L.1
Morales De Tirado, P.I.2
Severance, D.L.3
-
49
-
-
33751155589
-
-
(g) Wiberg, K. B.; Keith, T. A.; Frisch, M. J.; Murcko, M. J. Phys. Chem. 1995, 99, 9072-9079.
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 9072-9079
-
-
Wiberg, K.B.1
Keith, T.A.2
Frisch, M.J.3
Murcko, M.4
-
50
-
-
37049069591
-
-
Chiara, J. L.; Gómez-Sánchez, A.; Bellanato, J. J. Chem. Soc., Perkin Trans. 2 1992, 787-798.
-
(1992)
J. Chem. Soc., Perkin Trans. 2
, pp. 787-798
-
-
Chiara, J.L.1
Gómez-Sánchez, A.2
Bellanato, J.3
-
51
-
-
0000978794
-
-
Wiberg, K. B.; Rablen, P. R.; Rush, D. J.; Keith, T. A. J. Am. Chem. Soc. 1995, 117, 4261-4270.
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 4261-4270
-
-
Wiberg, K.B.1
Rablen, P.R.2
Rush, D.J.3
Keith, T.A.4
-
52
-
-
0030123810
-
-
Craw, J. S.; Guest, J. M.; Cooper, M. D.; Burton, N. A.; Hillier, I. H. J. Phys. Chem. 1996, 100, 6304-6309.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 6304-6309
-
-
Craw, J.S.1
Guest, J.M.2
Cooper, M.D.3
Burton, N.A.4
Hillier, I.H.5
-
53
-
-
8644282404
-
-
Pappalardo, R. R.; Marcos, E. S.; Ruiz-López, M. F.; Rinaldi, D.; Rivail, J.-L. J. Am. Chem. Soc. 1993, 115, 3722-3730.
-
(1993)
J. Am. Chem. Soc.
, vol.115
, pp. 3722-3730
-
-
Pappalardo, R.R.1
Marcos, E.S.2
Ruiz-López, M.F.3
Rinaldi, D.4
Rivail, J.-L.5
-
54
-
-
0003302545
-
-
Filleux-Blanchard, M. L.; Clesse, F.; Bignebat, J.; Martin, G. J. Tetrahedron Lett. 1969, 12, 981-984.
-
(1969)
Tetrahedron Lett.
, vol.12
, pp. 981-984
-
-
Filleux-Blanchard, M.L.1
Clesse, F.2
Bignebat, J.3
Martin, G.J.4
-
55
-
-
0001402646
-
-
Suarez, C.; LeMaster, C. B.; LeMaster, C. L.; Tafazzoli, M.; True, N. S. J. Phys. Chem. 1990, 94, 6679-6683.
-
(1990)
J. Phys. Chem.
, vol.94
, pp. 6679-6683
-
-
Suarez, C.1
LeMaster, C.B.2
LeMaster, C.L.3
Tafazzoli, M.4
True, N.S.5
-
57
-
-
0000078321
-
-
Gao, J. J. Am. Chem. Soc. 1993, 115, 2930-2935. Gao, J. Proc. Indian Acad. Sci. 1994, 106, 507.
-
(1993)
J. Am. Chem. Soc.
, vol.115
, pp. 2930-2935
-
-
Gao, J.1
-
58
-
-
0028408529
-
-
Gao, J. J. Am. Chem. Soc. 1993, 115, 2930-2935. Gao, J. Proc. Indian Acad. Sci. 1994, 106, 507.
-
(1994)
Proc. Indian Acad. Sci.
, vol.106
, pp. 507
-
-
Gao, J.1
-
59
-
-
33845469108
-
-
(a) Ross, B. D.; True, N. S. J. Am. Chem. Soc. 1984, 106, 2451-2452. Cf. LeMaster, C. B.; True, N. S. J. Phys. Chem. 1989, 93, 1307- 1311.
-
(1984)
J. Am. Chem. Soc.
, vol.106
, pp. 2451-2452
-
-
Ross, B.D.1
True, N.S.2
-
60
-
-
33845184693
-
-
(a) Ross, B. D.; True, N. S. J. Am. Chem. Soc. 1984, 106, 2451- 2452. Cf. LeMaster, C. B.; True, N. S. J. Phys. Chem. 1989, 93, 1307-1311.
-
(1989)
J. Phys. Chem.
, vol.93
, pp. 1307-1311
-
-
LeMaster, C.B.1
True, N.S.2
-
61
-
-
0001743882
-
-
(b) Ross, B. D.; True, N. S.; Matson, G. B. J. Phys. Chem. 1984, 88, 2675-2678.
-
(1984)
J. Phys. Chem.
, vol.88
, pp. 2675-2678
-
-
Ross, B.D.1
True, N.S.2
Matson, G.B.3
-
63
-
-
0001460001
-
-
‡ values reported in (c) and (d) were based on a transmission coefficient of 1.0, and were recalculated by using 0.5 to be consistent with the values given in (a) and (b) and the values reported in the current work.
-
(1983)
J. Phys. Chem.
, vol.87
, pp. 3054-3058
-
-
Feigel, M.1
-
64
-
-
0041401966
-
-
(a) Curtiss, L. A.; Raghavachari, K.; Trucks, G. W.; Pople, J. A. J. Chem. Phys. 1991, 94, 7221-7230.
-
(1991)
J. Chem. Phys.
, vol.94
, pp. 7221-7230
-
-
Curtiss, L.A.1
Raghavachari, K.2
Trucks, G.W.3
Pople, J.A.4
-
65
-
-
36449002592
-
-
(b) Curtiss, L. A.; Carpenter, J. E.; Raghavachari, K.; Pople, J. A. J. Chem. Phys. 1992, 96, 9030-9034.
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 9030-9034
-
-
Curtiss, L.A.1
Carpenter, J.E.2
Raghavachari, K.3
Pople, J.A.4
-
68
-
-
84962424239
-
-
note
-
Since there is no way to correlate the two different transition states of DMF with those of DMAAN, we have simply used the average of the values reported for the two DMF transition states. The differences in the thermodynamic corrections for methyl rotation and nitrogen inversion between the two DMF transition states are extremely small (less than 0.05 kcal/mol).
-
-
-
-
73
-
-
49549147422
-
-
(b) Dahlquist, F. W.; Longmuir, K. J.; DuVernet, R. B. J. Magn. Reson. 1975, 17, 406.
-
(1975)
J. Magn. Reson.
, vol.17
, pp. 406
-
-
Dahlquist, F.W.1
Longmuir, K.J.2
DuVernet, R.B.3
-
78
-
-
0002641348
-
-
(e) Grassi, M.; Mann, B. E.; Pickup, B. T.; Spencer, C. M. J. Magn. Reson. 1986, 69, 92.
-
(1986)
J. Magn. Reson.
, vol.69
, pp. 92
-
-
Grassi, M.1
Mann, B.E.2
Pickup, B.T.3
Spencer, C.M.4
-
79
-
-
0005819970
-
-
(f) Engler, R. E.; Johnston, E. R.; Wade, C. G. J. Magn. Reson. 1988, 77, 377.
-
(1988)
J. Magn. Reson.
, vol.77
, pp. 377
-
-
Engler, R.E.1
Johnston, E.R.2
Wade, C.G.3
-
80
-
-
0001232909
-
-
Perrin, C. L.; Thoburn, J. D.; Kresge, A. J. J. Am. Chem. Soc. 1992, 114, 8800-8807.
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 8800-8807
-
-
Perrin, C.L.1
Thoburn, J.D.2
Kresge, A.J.3
-
81
-
-
0345234994
-
-
Hobson, R. F.; Reeves, L. W. J. Phys. Chem. 1973, 77, 419-422. This study does not report rate constants (only energy barriers), and does not specify whether a transmission coefficient of 1.0 or 0.5 was used, and so the value reported for the barrier to DMAAN C-N bond rotation in carbon tetrachloride cannot reliably be compared to the present results in an exact manner.
-
(1973)
J. Phys. Chem.
, vol.77
, pp. 419-422
-
-
Hobson, R.F.1
Reeves, L.W.2
-
83
-
-
84962410116
-
-
note
-
The values given here (5.1 kcal/mol for vinylamine, 7.5 kcal/mol for DMAAN) are calculated enthalpies at 0 K.
-
-
-
-
84
-
-
84962410113
-
-
note
-
It is worthy of note that the data point for acetonitrile in Figure 3 lies somewhat above the best fit line, indicating a higher barrier than in other solvents having comparable values for the Onsager dielectric function. This deviation possibly indicates that acetonitrile, like the aromatic and chlorinated solvents, yields somewhat stronger than expected interactions with polar solutes due to unusually great electronic polarizability. The "soft" π-system of acetonilrile could certainly account for such polarizability. A similar pattern was observed with DMA and DMF previously, where again acetonitrile yielded a somewhat stronger solvent effect than did acetone.
-
-
-
-
85
-
-
26444458905
-
-
(a) Perng, B.-C.; Newton, M. D.; Raineri, F. O.; Friedman, H. L. J. Chem. Phys. 1996, 104, 7153-7176.
-
(1996)
J. Chem. Phys.
, vol.104
, pp. 7153-7176
-
-
Perng, B.-C.1
Newton, M.D.2
Raineri, F.O.3
Friedman, H.L.4
-
86
-
-
0000528932
-
-
(b) Perng, B.-C.; Newton, M. D.; Raineri, F. O.; Friedman, H. L. J. Chem. Phys. 1996, 104, 7177-7204.
-
(1996)
J. Chem. Phys.
, vol.104
, pp. 7177-7204
-
-
Perng, B.-C.1
Newton, M.D.2
Raineri, F.O.3
Friedman, H.L.4
-
87
-
-
84962410120
-
-
note
-
"Polarity" here is meant as measured by the Onsager dielectric function.
-
-
-
-
88
-
-
84962407779
-
-
Ph.D. Thesis, Yale University
-
Rablen, P. R. Ph.D. Thesis, Yale University, 1994.
-
(1994)
-
-
Rablen, P.R.1
-
94
-
-
0001217756
-
-
Ammann, C.; Meier, P.; Merbach, A. E. J. Magn. Reson. 1982, 46, 319-321.
-
(1982)
J. Magn. Reson.
, vol.46
, pp. 319-321
-
-
Ammann, C.1
Meier, P.2
Merbach, A.E.3
-
95
-
-
84962456992
-
-
Swarthmore College
-
Rablen, P. R. CVT_NMR, Swarthmore College, 1996.
-
(1996)
CVT_NMR
-
-
Rablen, P.R.1
-
96
-
-
84962405687
-
-
Yale University
-
Rablen, P. R. MUTEX, Yale University, 1993.
-
(1993)
MUTEX
-
-
Rablen, P.R.1
-
98
-
-
84962381845
-
-
Yale University
-
Rablen, P. R. SIR; Yale University, 1994.
-
(1994)
SIR
-
-
Rablen, P.R.1
-
99
-
-
0010922186
-
-
Gaussian, Inc.: Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Gill, P. M. W.; Johnson, B. G.; Robb, M. A.; Cheeseman, J. R.; Keith, T.; Petersson, G. A.; Montgomery, J. A.; Raghavachari, K.; Al-Laham, M. A.; Zakrzewski, V. G.; Ortiz, J. V.; Foresman, J. B.; Cioslowski, J.; Stefanov, B. B.; Nanayakkara, A.; Challacombe, M.; Peng, C. Y.; Ayala, P. Y.; Chen, W.; Wong, M. W.; Andres, J. L.; Replogle, E. S.; Gomperts, R.; Gonzalez, C.; Martin, R. L.; Fox, D. J.; Binkley, J. S.; Defrees, D. J.; Baker, J.; Stewart, J. P.; Head-Gordon, M.; Gonzalez, C.; Pople, J. A. Gaussian 94 (Revision C.2); Gaussian, Inc.: Pittsburgh, PA, 1995.
-
(1995)
Gaussian 94 (Revision C.2)
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Robb, M.A.6
Cheeseman, J.R.7
Keith, T.8
Petersson, G.A.9
Montgomery, J.A.10
Raghavachari, K.11
Al-Laham, M.A.12
Zakrzewski, V.G.13
Ortiz, J.V.14
Foresman, J.B.15
Cioslowski, J.16
Stefanov, B.B.17
Nanayakkara, A.18
Challacombe, M.19
Peng, C.Y.20
Ayala, P.Y.21
Chen, W.22
Wong, M.W.23
Andres, J.L.24
Replogle, E.S.25
Gomperts, R.26
Gonzalez, C.27
Martin, R.L.28
Fox, D.J.29
Binkley, J.S.30
Defrees, D.J.31
Baker, J.32
Stewart, J.P.33
Head-Gordon, M.34
Gonzalez, C.35
Pople, J.A.36
more..
|