Crossref
journal-article
American Chemical Society (ACS)
The Journal of Physical Chemistry A (316)
References
103
Referenced
31
10.1021/cr950047g
/ Chem. Rev. by Klinman J. P. (1996)10.1002/anie.199600431
/ Angew. Chem., Int. Ed. Engl. by Kaim W. (1996)10.1021/cr950046o
/ Chem. Rev. by Solomon E. (1996)10.1038/4193
/ Nature Struct. Biol. by Klabunde T. (1998)10.1021/bi982284u
/ Biochemistry by Hart P. J. (1999)10.1021/cr00027a010
/ Chem. Rev. by Kitajima N. (1994)10.1021/ar950257f
/ Acc. Chem. Res. by Karlin K. D. (1997)10.1021/ic9601100
/ Inorg. Chem. by Casella L. (1996)10.1039/a805754k
/ New J. Chem. by Blanchard S. (1998)10.1021/ja00112a009
/ J. Am. Chem. Soc. by Pierre J. L. (1995)10.1021/ja994050j
/ J. Am. Chem. Soc. by Ohtsu H. (2000)10.1021/ic9713689
/ Inorg. Chem. by Ghosh D. (1998)10.1021/ic990095+
/ Inorg. Chem. by Cahoy J. (1999)10.1002/(SICI)1521-3765(20000303)6:5<914::AID-CHEM914>3.0.CO;2-K
/ Chem. Eur. J. by Börzel H. (2000)10.1021/ja992017r
/ J. Am. Chem. Soc. by Hu Z. (2000)10.1021/ic971010c
/ Inorg. Chem. by Ryan S. (1998)10.1039/a801343h
/ Chem. Comm. by Liu X. Y. (1998)10.1039/a702793a
/ Chem. Commun. by Siemeling U. (1997)10.1021/ic980464m
/ Inorg. Chem. by Darensbourg D. J. (1998)10.1002/(SICI)1521-3765(19990104)5:1<65::AID-CHEM65>3.0.CO;2-L
/ Chem. Eur. J. by Gebbink R. J. M. K. (1999)10.1002/(SICI)1521-3765(19991105)5:11<3124::AID-CHEM3124>3.0.CO;2-D
/ Chem. Eur. J. by Becker M. (1999)10.1002/(SICI)1521-3765(19990903)5:9<2573::AID-CHEM2573>3.0.CO;2-J
/ Chem. Eur. J. by Lupinetti A. J. (1999)10.1002/(SICI)1521-3773(19990816)38:16<2401::AID-ANIE2401>3.0.CO;2-V
/ Angew. Chem., Int. Ed. by Shimazaki Y. (1999)10.1073/pnas.84.9.2565
/ Proc. Natl. Acad. Sci. by Lehn J. M. (1987)10.1073/pnas.90.12.5394
/ Proc. Natl. Acad. Sci. by Kramer R. (1993)10.1002/anie.199314631
/ Angew. Chem., Int. Ed. by Carina R. F. (1993)10.1002/anie.199725091
/ Angew Chem. Int. Ed. Engl. by Ziessel R. (1997)10.1002/(SICI)1521-3773(19990201)38:3<379::AID-ANIE379>3.0.CO;2-Y
/ Angew. Chem., Int. Ed. by Dubner F. (1999)10.1039/b004806m
/ J. Chem. Commun. by Diaz-Requejo M. R. (2000)10.1002/(SICI)1099-0682(199811)1998:11<1799::AID-EJIC1799>3.0.CO;2-6
/ Eur. J. Inorg. Chem. by Haddleton D. M. (1998)10.1063/1.459929
/ J. Chem. Phys. by Bauschlicher C. W. (1991)10.1039/a801560k
/ Chem. Commun. by Poblet J.-M. (1998)10.1021/ja963432b
/ J. Am. Chem. Soc. by Hoyau S. (1997)10.1002/(SICI)1521-3765(19990903)5:9<2573::AID-CHEM2573>3.0.CO;2-J
/ Chem. Eur. J. by Lupinetti A. J. (1999)10.1021/jp9929115
/ J. Phys. Chem. A by El-Nahas A. M. (2000)10.1021/jp980629c
/ J. Phys. Chem. A by Luna A. (1998)10.1016/0009-2614(95)00834-Q
/ Chem. Phys. Lett. by Ouhlal A. (1995)10.1021/ic991064h
/ Inorg. Chem. by Dattelbaum A. M. (1999)10.1021/ja971231h
/ J. Am. Chem. Soc. by Estiu G. L. (1999)10.1021/ja983310e
/ J. Am. Chem. Soc. by Pidcock E. (1999)10.1002/(SICI)1521-3765(19980710)4:7<1297::AID-CHEM1297>3.0.CO;2-H
/ Chem. Eur. J. by Berces A. (1998)10.1021/ic9515766
/ Inorg. Chem. by Eisenstein O. (1997)10.1002/(SICI)1097-461X(1996)58:1<109::AID-QUA10>3.0.CO;2-2
/ Int. J. Quantum Chem. by Bernardi F. (1996)10.1021/ja962455n
/ J. Am. Chem. Soc. by Cramer C. J. (1996)10.1021/ic970396o
/ Inorg. Chem. by Berces A. (1997)10.1021/jp9813241
/ J. Phys. Chem. A by Flock M. (1999)10.1021/jp982321r
/ J. Phys. Chem. B by Lind T. (1999)10.1021/ja994527r
/ J. Am. Chem. Soc. by Himo F. (2000)10.1021/ja00051a040
/ J. Am. Chem. Soc. by Rappé A. K. (1992)- (b) esff force-field, Insight/Discover package, Accelrys Inc., 9685 Scranton Rd., San Diego, CA, 1995.
10.1002/(SICI)1096-987X(199604)17:5/6<616::AID-JCC5>3.0.CO;2-X
/ J. Comput. Chem. by Halgren T. A. (1996){'key': 'jp0106146b00016/jp0106146b00016_1', 'first-page': '279', 'volume': '21', 'author': 'Gresh N.', 'year': '1997', 'journal-title': 'New J. Chem.'}
/ New J. Chem. by Gresh N. (1997)10.1002/jcc.540160705
/ J. Comput. Chem. by Gresh N. (1995)10.1002/(SICI)1096-987X(199609)17:12<1481::AID-JCC7>3.0.CO;2-G
/ J. Comput. Chem. by Gresh N. (1996)10.1051/jcp/1997941365
/ J. Chim. Phys. by Gresh N. (1997)10.1021/jp9713423
/ J. Phys. Chem. A by Gresh N. (1997)10.1002/(SICI)1097-0134(19980401)31:1<42::AID-PROT5>3.0.CO;2-J
/ Prot. Struct. Funct. Genet. by Garmer D. R. (1998)10.1021/ja9742489
/ J. Am. Chem. Soc. by Gresh N. (1999)10.1002/1096-987X(200009)21:12<1011::AID-JCC1>3.0.CO;2-B
/ J. Comput. Chem. by Tiraboschi G. (2000)10.1002/(SICI)1097-461X(2000)77:1<421::AID-QUA42>3.0.CO;2-#
/ Int. J. Quantum Chem. by Cundari T. R. (2000)- (b) Spartan 5.0.3; Wave function Inc. Irvine, CA, 1997.
10.1021/ja00522a025
/ J. Am. Chem. Soc. by Zerner M. C. (1980){'key': 'jp0106146b00019/jp0106146b00019_2', 'volume-title': 'Quantum Theory Project', 'author': 'Zerner M. C.', 'year': '1998'}
/ Quantum Theory Project by Zerner M. C. (1998)10.1042/bj1390049
/ Biochem. J. by Fielden E. M. (1974){'key': 'jp0106146b00020/jp0106146b00020_2', 'first-page': '798', 'volume': '115', 'author': 'Whittaker M. M.', 'year': '1988', 'journal-title': 'J. Biol. Chem.'}
/ J. Biol. Chem. by Whittaker M. M. (1988)10.1063/1.447604
/ J. Chem. Phys. by Stevens W. J. (1984)10.1021/ja00087a049
/ J. Am. Chem. Soc. by Garmer D. R. (1994)10.1002/jcc.540160704
/ J. Comput. Chem. by Gresh N. (1995)10.1139/v92-079
/ Can. J. Chem. by Godbout N. (1992)10.1063/1.463096
/ J. Chem. Phys. by Schafer A. (1992)10.1016/0009-2614(87)80143-4
/ Chem. Phys. Lett. by Stevens W. J. (1987)10.1002/jcc.540141112
/ J. Comput. Chem. by Schmidt M. W. (1993)10.1002/qua.560100211
/ Int. J. Quantum Chem. by Kitaura K. (1976)10.1063/1.447215
/ J. Chem. Phys. by Bagus P. S. (1984)10.1002/qua.560230308
/ Int. J. Quantum Chem. by Sokalski W. A. (1983){'key': 'jp0106146b00030/jp0106146b00030_1', 'volume-title': 'Gaussian 98, revision A.7', 'author': 'Frisch M. J.', 'year': '1998'}
/ Gaussian 98, revision A.7 by Frisch M. J. (1998)10.1103/PhysRevB.37.785
/ Phys. Rev. by Lee C. (1988)10.1063/1.464304
/ J. Chem. Phys. by Becke A. (1993)- Jaguar 4.0, Schödinger, Inc. Portland, OR, 1991−2000
10.1063/1.454705
/ J. Chem. Phys. by Vigné-Maeder F. (1988)10.1021/j100362a023
/ J. Phys. Chem. by Garmer D. R. (1989)10.1051/jcp/1991882399
/ J. Chim.-Phys by Creuzet S. (1991)10.1007/BF01113842
/ Theor. Chim. Acta by Pou-AméRigo R. (1995)10.1016/0010-4655(87)90094-4
/ Comput. Phys. Commun. by Evangelakis G. (1987)10.1002/1096-987X(200008)21:11<963::AID-JCC6>3.0.CO;2-3
/ J. Comput. Chem. by Rogalewicz F. (2000)10.1002/jcc.1064
/ J. Comput. Chem. by Tiraboschi G. (2001)10.1016/S0009-2614(97)01152-4
/ Chem. Phys. Lett. by Hoyau S. (1997)10.1021/bi00200a022
/ Biochemistry by Blackburn N. J. (1994)10.1016/S0006-3495(96)79478-X
/ Biophysical J. by Karpefors M. (1996)10.1021/bi9728598
/ Biochemistry by Salgado J. (1998)10.1021/ja010315u
/ J. Am. Chem. Soc. by Olsson M. H. (2001)10.1038/4193
/ Nature Struct. Biol. by Klabunde T. (1998)10.1002/prot.340190405
/ J. Proteins by Magnus K. A. (1994)10.1016/0022-2836(92)90583-6
/ J. Mol. Biol. by Messerschmidt A. (1992)10.1016/0022-2836(89)90276-3
/ J. Mol. Biol. by Volbeda A. (1989)10.1021/ic970996n
/ Inorg. Chem. by Monzani E. (1998)10.1002/(SICI)1099-0682(199809)1998:9<1297::AID-EJIC1297>3.0.CO;2-M
/ Eur. J. Inorg. Chem. by Blain I. (1998)10.1021/jp951690+
/ J. Phys. Chem. by Getlicherman H. (1996){'key': 'jp0106146b00045/jp0106146b00045_1', 'first-page': '8049', 'volume': '105', 'author': 'Krauss M.', 'year': '2001', 'journal-title': 'J. Phys. Chem. B'}
/ J. Phys. Chem. B by Krauss M. (2001)10.1007/BF00577135
/ Theor. Chim. Acta by Gresh N. (1984)10.1002/(SICI)1097-0282(199702)41:2<145::AID-BIP3>3.0.CO;2-T
/ Biopolymers by Gresh N. (1997){'key': 'jp0106146b00047/jp0106146b00047_2', 'author': 'Antony J.', 'journal-title': 'J. Comput. Chem., in press.'}
/ J. Comput. Chem., in press. by Antony J.- bMP2 single point calculations using the DFT optimized geometries and the CEP 4-31G basis.
Dates
Type | When |
---|---|
Created | 23 years, 1 month ago (July 26, 2002, 2:10 a.m.) |
Deposited | 3 years, 10 months ago (Oct. 17, 2021, 1:29 p.m.) |
Indexed | 1 year, 3 months ago (May 30, 2024, 5:51 p.m.) |
Issued | 23 years, 3 months ago (May 15, 2002) |
Published | 23 years, 3 months ago (May 15, 2002) |
Published Online | 23 years, 3 months ago (May 15, 2002) |
Published Print | 23 years, 3 months ago (June 1, 2002) |
@article{Gresh_2002, title={Modeling Copper(I) Complexes: SIBFA Molecular Mechanics versus ab Initio Energetics and Geometrical Arrangements}, volume={106}, ISSN={1520-5215}, url={http://dx.doi.org/10.1021/jp0106146}, DOI={10.1021/jp0106146}, number={23}, journal={The Journal of Physical Chemistry A}, publisher={American Chemical Society (ACS)}, author={Gresh, N. and Policar, C. and Giessner-Prettre, C.}, year={2002}, month=may, pages={5660–5670} }