-
1
-
-
4243545125
-
Oxidative Nucleobase Modifications Leading to Strand Scission
-
Burrows, C. J.; Muller, J. G. Oxidative Nucleobase Modifications Leading to Strand Scission Chem. Rev. 1998, 98, 1109-1151
-
(1998)
Chem. Rev.
, vol.98
, pp. 1109-1151
-
-
Burrows, C.J.1
Muller, J.G.2
-
2
-
-
0000589097
-
Photocleavage of Nucleic Acids
-
Armitage, B. Photocleavage of Nucleic Acids Chem. Rev. 1998, 98, 1171-1200
-
(1998)
Chem. Rev.
, vol.98
, pp. 1171-1200
-
-
Armitage, B.1
-
3
-
-
0035915333
-
Charge Transport in DNA Via Thermally Induced Hopping
-
Bixon, M.; Jortner, J. Charge Transport in DNA Via Thermally Induced Hopping J. Am. Chem. Soc. 2001, 123, 12556-12567
-
(2001)
J. Am. Chem. Soc.
, vol.123
, pp. 12556-12567
-
-
Bixon, M.1
Jortner, J.2
-
4
-
-
0037149808
-
Quantum Chemical Modeling of Electron Hole Transfer through Pi Stacks of Normal and Modified Pairs of Nucleobases
-
Voityuk, A. A.; Rosch, N. Quantum Chemical Modeling of Electron Hole Transfer through Pi Stacks of Normal and Modified Pairs of Nucleobases J. Phys. Chem. B 2002, 106, 3013-3018
-
(2002)
J. Phys. Chem. B
, vol.106
, pp. 3013-3018
-
-
Voityuk, A.A.1
Rosch, N.2
-
5
-
-
33845659916
-
PH-Dependent Mismatch Discrimination of Oligonucleotide Duplexes Containing 2′-Deoxytubercidin and 2- or 7-Substituted Derivatives: Protonated Base Pairs Formed between 7-Deazapurines and Cytosine
-
Peng, X. H.; Li, H.; Seela, F. pH-Dependent Mismatch Discrimination of Oligonucleotide Duplexes Containing 2′-Deoxytubercidin and 2- or 7-Substituted Derivatives: Protonated Base Pairs Formed between 7-Deazapurines and Cytosine Nucleic Acids Res. 2006, 34, 5987-6000
-
(2006)
Nucleic Acids Res.
, vol.34
, pp. 5987-6000
-
-
Peng, X.H.1
Li, H.2
Seela, F.3
-
6
-
-
67650468760
-
Sequence-Independent and Rapid Long-Range Charge Transfer through DNA
-
Kawai, K.; Kodera, H.; Osakada, Y.; Majima, T. Sequence-Independent and Rapid Long-Range Charge Transfer through DNA Nat. Chem. 2009, 1, 156-159
-
(2009)
Nat. Chem.
, vol.1
, pp. 156-159
-
-
Kawai, K.1
Kodera, H.2
Osakada, Y.3
Majima, T.4
-
7
-
-
79960875177
-
Increasing the Speed Limit for Hole Transport in DNA
-
Thazhathveetil, A. K.; Trifonov, A.; Wasielewski, M. R.; Lewis, F. D. Increasing the Speed Limit for Hole Transport in DNA J. Am. Chem. Soc. 2011, 133, 11485-11487
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 11485-11487
-
-
Thazhathveetil, A.K.1
Trifonov, A.2
Wasielewski, M.R.3
Lewis, F.D.4
-
8
-
-
84860523929
-
Electronic Interactions in Helical Stacked Arrays of the Modified DNA Base Pyrrolocytosine
-
Neelakandan, P. P.; McCullagh, M.; Schatz, G. C.; Lewis, F. D. Electronic Interactions in Helical Stacked Arrays of the Modified DNA Base Pyrrolocytosine J. Phys. Chem. B 2012, 116, 5199-5204
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 5199-5204
-
-
Neelakandan, P.P.1
McCullagh, M.2
Schatz, G.C.3
Lewis, F.D.4
-
9
-
-
84862277100
-
Electrochemistry of Nucleic Acids
-
Paleček, E.; Bartošík, M. Electrochemistry of Nucleic Acids Chem. Rev. 2012, 112, 3427-3481
-
(2012)
Chem. Rev.
, vol.112
, pp. 3427-3481
-
-
Paleček, E.1
Bartošík, M.2
-
10
-
-
2542537290
-
Charge Transfer between Nucleic Acid Bases and Chloranil
-
Machmer, P.; Duchesne, J. Charge Transfer between Nucleic Acid Bases and Chloranil Nature 1965, 206, 618-619
-
(1965)
Nature
, vol.206
, pp. 618-619
-
-
Machmer, P.1
Duchesne, J.2
-
11
-
-
0015231794
-
Molecular Interactions between Amino Acids and Nucleic Acid Components. 2. Reflectance and Luminescence Studies of Molecular Complex Formation between Tryptophan and Nucleic Acid Components in Frozen Aqueous Solutions
-
Montenay, T.; Hélène, C. Molecular Interactions between Amino Acids and Nucleic Acid Components. 2. Reflectance and Luminescence Studies of Molecular Complex Formation between Tryptophan and Nucleic Acid Components in Frozen Aqueous Solutions Biochemistry 1971, 10, 300-306
-
(1971)
Biochemistry
, vol.10
, pp. 300-306
-
-
Montenay, T.1
Hélène, C.2
-
12
-
-
0015931510
-
Complex-Formation between Purine and Indole-Derivatives in Aqueous-Solutions - Proton Magnetic-Resonance Studies
-
Dimicoli, J. L.; Hélène, C. Complex-Formation between Purine and Indole-Derivatives in Aqueous-Solutions-Proton Magnetic-Resonance Studies J. Am. Chem. Soc. 1973, 95, 1036-1044
-
(1973)
J. Am. Chem. Soc.
, vol.95
, pp. 1036-1044
-
-
Dimicoli, J.L.1
Hélène, C.2
-
13
-
-
84970566644
-
Charge-Transfer Complexes of Purines and Pyrimidines
-
Fulton, A.; Lyons, L. E. Charge-Transfer Complexes of Purines and Pyrimidines Aust. J. Chem. 1968, 21, 419-423
-
(1968)
Aust. J. Chem.
, vol.21
, pp. 419-423
-
-
Fulton, A.1
Lyons, L.E.2
-
14
-
-
0019430488
-
Charge Transfer Complexes of Nucleic Acid Purine Bases with Benzoquinone. Evidence That Nucleic Acid Components Are Pi-Donors
-
Malevskii, A. A.; Rapoport, V. L.; Tretyakov, A. N. Charge Transfer Complexes of Nucleic Acid Purine Bases with Benzoquinone. Evidence That Nucleic Acid Components Are Pi-Donors Mol. Biol. 1981, 15, 447-453
-
(1981)
Mol. Biol.
, vol.15
, pp. 447-453
-
-
Malevskii, A.A.1
Rapoport, V.L.2
Tretyakov, A.N.3
-
15
-
-
0000970890
-
Thermodynamic Nucleic Base Specificity in Nucleotide Metallointercalator Association - Structure Stability Relationship Showing Significant Contribution of the Amino Group to Aromatic Ring Stacking
-
Odani, A.; Masuda, H.; Yamauchi, O.; Ishiguro, S. Thermodynamic Nucleic Base Specificity in Nucleotide Metallointercalator Association-Structure Stability Relationship Showing Significant Contribution of the Amino Group to Aromatic Ring Stacking Inorg. Chem. 1991, 30, 4484-4486
-
(1991)
Inorg. Chem.
, vol.30
, pp. 4484-4486
-
-
Odani, A.1
Masuda, H.2
Yamauchi, O.3
Ishiguro, S.4
-
17
-
-
0011397457
-
Optical Charge Transfer in the Ion Pairs Methyl Viologen(2+) Guanosine-5′-monophosphate(2-) and Adenosine-5′-triphosphate(2-)
-
Kunkely, H.; Vogler, A. Optical Charge Transfer in the Ion Pairs Methyl Viologen(2+) Guanosine-5′-monophosphate(2-) and Adenosine-5′- triphosphate(2-) Chem. Phys. Lett. 2001, 345, 309-311
-
(2001)
Chem. Phys. Lett.
, vol.345
, pp. 309-311
-
-
Kunkely, H.1
Vogler, A.2
-
18
-
-
0012651076
-
Complexes of Paraquat with Guanine Bases Detected by Electrospray Ionization-Mass Spectrometry
-
Moriwaki, H. Complexes of Paraquat with Guanine Bases Detected by Electrospray Ionization-Mass Spectrometry J. Mass Spec. Soc. Jap. 2002, 50, 18-20
-
(2002)
J. Mass Spec. Soc. Jap.
, vol.50
, pp. 18-20
-
-
Moriwaki, H.1
-
19
-
-
0000731910
-
Photoinduced Electron-Transfer in DNA Matrix from Intercalated Ethidium to Condensed Methylviologen
-
Fromherz, P.; Rieger, B. Photoinduced Electron-Transfer in DNA Matrix from Intercalated Ethidium to Condensed Methylviologen J. Am. Chem. Soc. 1986, 108, 5361-5362
-
(1986)
J. Am. Chem. Soc.
, vol.108
, pp. 5361-5362
-
-
Fromherz, P.1
Rieger, B.2
-
20
-
-
4544302875
-
Phenanthridinium as an Artificial Base and Charge Donor in DNA
-
Amann, N.; Huber, R.; Wagenknecht, H. A. Phenanthridinium as an Artificial Base and Charge Donor in DNA Angew. Chem., Int. Edit. 2004, 43, 1845-1847
-
(2004)
Angew. Chem., Int. Edit.
, vol.43
, pp. 1845-1847
-
-
Amann, N.1
Huber, R.2
Wagenknecht, H.A.3
-
21
-
-
0026458382
-
Base-Selective Oxidation and Cleavage of DNA by Photochemical Cosensitized Electron-Transfer
-
Dunn, D. A.; Lin, V. H.; Kochevar, I. E. Base-Selective Oxidation and Cleavage of DNA by Photochemical Cosensitized Electron-Transfer Biochemistry 1992, 31, 11620-11625
-
(1992)
Biochemistry
, vol.31
, pp. 11620-11625
-
-
Dunn, D.A.1
Lin, V.H.2
Kochevar, I.E.3
-
22
-
-
33845281801
-
Laser Flash-Photolysis of DNA-Intercalated Ethidium-Bromide in the Presence of Methylviologen
-
Atherton, S. J.; Beaumont, P. C. Laser Flash-Photolysis of DNA-Intercalated Ethidium-Bromide in the Presence of Methylviologen J. Phys. Chem. 1987, 91, 3993-3997
-
(1987)
J. Phys. Chem.
, vol.91
, pp. 3993-3997
-
-
Atherton, S.J.1
Beaumont, P.C.2
-
23
-
-
33745882647
-
Base Pair Motions Control the Rates and Distance Dependencies of Reductive and Oxidative DNA Charge Transfer
-
Valis, L.; Wang, Q.; Raytchev, M.; Buchvarov, I.; Wagenknecht, H. A.; Fiebig, T. Base Pair Motions Control the Rates and Distance Dependencies of Reductive and Oxidative DNA Charge Transfer Proc. Natl. Acad. Sci. U. S. A. 2006, 103, 10192-10195
-
(2006)
Proc. Natl. Acad. Sci. U. S. A.
, vol.103
, pp. 10192-10195
-
-
Valis, L.1
Wang, Q.2
Raytchev, M.3
Buchvarov, I.4
Wagenknecht, H.A.5
Fiebig, T.6
-
25
-
-
0001312393
-
Perturbation-Theory Approach to Intermolecular Potential-Energy Surfaces of Van-Der-Waals Complexes
-
Jeziorski, B.; Moszynski, R.; Szalewicz, K. Perturbation-Theory Approach to Intermolecular Potential-Energy Surfaces of Van-Der-Waals Complexes Chem. Rev. 1994, 94, 1887-1930
-
(1994)
Chem. Rev.
, vol.94
, pp. 1887-1930
-
-
Jeziorski, B.1
Moszynski, R.2
Szalewicz, K.3
-
26
-
-
22944489600
-
Density-Functional Theory-Symmetry-Adapted Intermolecular Perturbation Theory with Density Fitting: A New Efficient Method to Study Intermolecular Interaction Energies
-
Hesselmann, A.; Jansen, G.; Schutz, M. Density-Functional Theory-Symmetry-Adapted Intermolecular Perturbation Theory with Density Fitting: A New Efficient Method To Study Intermolecular Interaction Energies J. Chem. Phys. 2005, 122, 014103
-
(2005)
J. Chem. Phys.
, vol.122
, pp. 014103
-
-
Hesselmann, A.1
Jansen, G.2
Schutz, M.3
-
27
-
-
10844224532
-
Fast Hartree-Fock Theory Using Local Density Fitting Approximations
-
Polly, R.; Werner, H. J.; Manby, F. R.; Knowles, P. J. Fast Hartree-Fock Theory Using Local Density Fitting Approximations Mol. Phys. 2004, 102, 2311-2321
-
(2004)
Mol. Phys.
, vol.102
, pp. 2311-2321
-
-
Polly, R.1
Werner, H.J.2
Manby, F.R.3
Knowles, P.J.4
-
28
-
-
84883171167
-
Nature of Noncovalent Interactions in Catenane Supramolecular Complexes: Calibrating the MM3 Force Field with Ab Initio, DFT, and SAPT Methods
-
Simeon, T. M.; Ratner, M. A.; Schatz, G. C. Nature of Noncovalent Interactions in Catenane Supramolecular Complexes: Calibrating the MM3 Force Field with Ab Initio, DFT, and SAPT Methods J. Phys. Chem. A 2013, 117, 7918-7927
-
(2013)
J. Phys. Chem. A
, vol.117
, pp. 7918-7927
-
-
Simeon, T.M.1
Ratner, M.A.2
Schatz, G.C.3
-
30
-
-
33947448345
-
Molecular Compounds and Their Spectra. 2
-
Mulliken, R. S. Molecular Compounds and Their Spectra. 2 J. Am. Chem. Soc. 1952, 74, 811-824
-
(1952)
J. Am. Chem. Soc.
, vol.74
, pp. 811-824
-
-
Mulliken, R.S.1
-
31
-
-
33746190548
-
A Spectrophotometric Investigation of the Interaction of Iodine with Aromatic Hydrocarbons
-
Benesi, H. A.; Hildebrand, J. H. A Spectrophotometric Investigation of the Interaction of Iodine with Aromatic Hydrocarbons J. Am. Chem. Soc. 1949, 71, 2703-2707
-
(1949)
J. Am. Chem. Soc.
, vol.71
, pp. 2703-2707
-
-
Benesi, H.A.1
Hildebrand, J.H.2
-
32
-
-
37049112005
-
X-ray Crystal-Structure of a 2:2 Chloroterpyridineplatinum(II)-Adenosine- 5′-monophosphate Intercalation Complex
-
Wong, Y.; Lippard, S. J. X-ray Crystal-Structure of a 2:2 Chloroterpyridineplatinum(II)-Adenosine-5′-monophosphate Intercalation Complex Chem. Commun. 1977, 824-825
-
(1977)
Chem. Commun.
, pp. 824-825
-
-
Wong, Y.1
Lippard, S.J.2
-
33
-
-
0001122310
-
Platinum DNA Intercalator Mononucleotide Adduct Formation - Cooperativity between Aromatic Ring Stacking and Electrostatic Interactions
-
Odani, A.; Shimata, R.; Masuda, H.; Yamauchi, O. Platinum DNA Intercalator Mononucleotide Adduct Formation-Cooperativity between Aromatic Ring Stacking and Electrostatic Interactions Inorg. Chem. 1991, 30, 2133-2138
-
(1991)
Inorg. Chem.
, vol.30
, pp. 2133-2138
-
-
Odani, A.1
Shimata, R.2
Masuda, H.3
Yamauchi, O.4
-
34
-
-
0042415668
-
Combined Effects of Electrostatic and Pi-Pi Stacking Interactions: Selective Binding of Nucleotides and Aromatic Carboxylates by Platinum(II)-Aromatic Ligand Complexes
-
Yajima, T.; Maccarrone, G.; Takani, M.; Contino, A.; Arena, G.; Takamido, R.; Hanaki, M.; Funahashi, Y.; Odani, A.; Yamauchi, O. Combined Effects of Electrostatic and Pi-Pi Stacking Interactions: Selective Binding of Nucleotides and Aromatic Carboxylates by Platinum(II)-Aromatic Ligand Complexes Chem.-Eur. J. 2003, 9, 3341-3352
-
(2003)
Chem. - Eur. J.
, vol.9
, pp. 3341-3352
-
-
Yajima, T.1
Maccarrone, G.2
Takani, M.3
Contino, A.4
Arena, G.5
Takamido, R.6
Hanaki, M.7
Funahashi, Y.8
Odani, A.9
Yamauchi, O.10
-
35
-
-
0028105513
-
Supramolecular Chemistry. 46. Molecular Recognition of Nucleotides, Nucleosides, and Sugars by Aminocyclodextrins
-
Eliseev, A. V.; Schneider, H. J. Supramolecular Chemistry. 46. Molecular Recognition of Nucleotides, Nucleosides, and Sugars by Aminocyclodextrins J. Am. Chem. Soc. 1994, 116, 6081-6088
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 6081-6088
-
-
Eliseev, A.V.1
Schneider, H.J.2
-
36
-
-
0034697641
-
Highly Efficient Complexations of a Porphyrin Dimer with Remarkably Small Differences between Nucleosides and Nucleotides/The Predominance of Stacking Interactions for Nucleic Acid Components
-
Sirish, M.; Schneider, H. J. Highly Efficient Complexations of a Porphyrin Dimer with Remarkably Small Differences between Nucleosides and Nucleotides/The Predominance of Stacking Interactions for Nucleic Acid Components J. Am. Chem. Soc. 2000, 122, 5881-5882
-
(2000)
J. Am. Chem. Soc.
, vol.122
, pp. 5881-5882
-
-
Sirish, M.1
Schneider, H.J.2
-
37
-
-
84876257433
-
Interactions in Supramolecular Complexes Involving Arenes: Experimental Studies
-
Schneider, H. J. Interactions in Supramolecular Complexes Involving Arenes: Experimental Studies Acc. Chem. Res. 2013, 46, 1010-1019
-
(2013)
Acc. Chem. Res.
, vol.46
, pp. 1010-1019
-
-
Schneider, H.J.1
-
38
-
-
0016067145
-
Ternary Complexes in Solution. XVIII. Stability Enhancement of Nucleotide-Containing Charge-Transfer Adducts through the Formation of a Metal Ion Bridge
-
Naumann, C. F.; Sigel, H. Ternary Complexes in Solution. XVIII. Stability Enhancement of Nucleotide-Containing Charge-Transfer Adducts through the Formation of a Metal Ion Bridge J. Am. Chem. Soc. 1974, 96, 2750-2756
-
(1974)
J. Am. Chem. Soc.
, vol.96
, pp. 2750-2756
-
-
Naumann, C.F.1
Sigel, H.2
-
39
-
-
0000878756
-
Hydrophobic Interactions in Biological-Systems - Some Background Information Based on Ligand Ligand Interactions in Metal-Ion Complexes
-
Sigel, H. Hydrophobic Interactions in Biological-Systems-Some Background Information Based on Ligand Ligand Interactions in Metal-Ion Complexes Pure Appl. Chem. 1989, 61, 923-932
-
(1989)
Pure Appl. Chem.
, vol.61
, pp. 923-932
-
-
Sigel, H.1
-
40
-
-
84892617427
-
-
Chen, L.; Zhang, H.-Y.; Liu, Y. J. Org. Chem. 2012, 77, 1234-1345
-
(2012)
J. Org. Chem.
, vol.77
, pp. 1234-1345
-
-
Chen, L.1
Zhang, H.-Y.2
Liu, Y.3
-
41
-
-
84892569245
-
-
Cervantes, R.; Sanchez, R. I.; Tiburcio, J. Chem.-Eur. J. 2013, 19, 1234-2345
-
(2013)
Chem. - Eur. J.
, vol.19
, pp. 1234-2345
-
-
Cervantes, R.1
Sanchez, R.I.2
Tiburcio, J.3
-
42
-
-
0030134477
-
Solvation Free Energies of the Nucleic Acid Bases
-
Miller, J. L.; Kollman, P. A. Solvation Free Energies of the Nucleic Acid Bases J. Phys. Chem. 1996, 100, 8587-8594
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 8587-8594
-
-
Miller, J.L.1
Kollman, P.A.2
-
43
-
-
79959387410
-
Conformational Control of Thymine Photodimerization in Purine-Containing Trinucleotides
-
Pan, Z. Z.; McCullagh, M.; Schatz, G. C.; Lewis, F. D. Conformational Control of Thymine Photodimerization in Purine-Containing Trinucleotides J. Phys. Chem. Lett. 2011, 2, 1432-1438
-
(2011)
J. Phys. Chem. Lett.
, vol.2
, pp. 1432-1438
-
-
Pan, Z.Z.1
McCullagh, M.2
Schatz, G.C.3
Lewis, F.D.4
-
44
-
-
0141665494
-
-
Ishida, T.; Murakami, M.; Watanabe, G.; Yoshikawa, H.; Nishikiori, S. Internet Electron. J. Mol. Des. 2003, 2, 14-23
-
(2003)
Internet Electron. J. Mol. Des.
, vol.2
, pp. 14-23
-
-
Ishida, T.1
Murakami, M.2
Watanabe, G.3
Yoshikawa, H.4
Nishikiori, S.5
-
45
-
-
33748496026
-
Interaction Energy Contributions of H-Bonded and Stacked Structures of the at and GC DNA Base Pairs from the Combined Density Functional Theory and Intermolecular Perturbation Theory Approach
-
Hesselmann, A.; Jansen, G.; Schutz, M. Interaction Energy Contributions of H-Bonded and Stacked Structures of the AT and GC DNA Base Pairs from the Combined Density Functional Theory and Intermolecular Perturbation Theory Approach J. Am. Chem. Soc. 2006, 128, 11730-11731
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 11730-11731
-
-
Hesselmann, A.1
Jansen, G.2
Schutz, M.3
-
46
-
-
84866624939
-
Effect of Structural Dynamics and Base Pair Sequence on the Nature of Excited States in DNA Hairpins
-
Patwardhan, S.; Tonzani, S.; Lewis, F. D.; Siebbeles, L. D. A.; Schatz, G. C.; Grozema, F. C. Effect of Structural Dynamics and Base Pair Sequence on the Nature of Excited States in DNA Hairpins J. Am. Chem. Soc. 2012, 116, 11447-11458
-
(2012)
J. Am. Chem. Soc.
, vol.116
, pp. 11447-11458
-
-
Patwardhan, S.1
Tonzani, S.2
Lewis, F.D.3
Siebbeles, L.D.A.4
Schatz, G.C.5
Grozema, F.C.6
-
47
-
-
0035850731
-
A Standard Reference Frame for the Description of Nucleic Acid Base-Pair Geometry
-
Olson, W. K.; Bansal, M.; Burley, S. K.; Dickerson, R. E.; Gerstein, M.; Harvey, S. C.; Heinemann, U.; Lu, X. J.; Neidle, S.; Shakked, Z. A Standard Reference Frame for the Description of Nucleic Acid Base-Pair Geometry J. Mol. Biol. 2001, 313, 229-237
-
(2001)
J. Mol. Biol.
, vol.313
, pp. 229-237
-
-
Olson, W.K.1
Bansal, M.2
Burley, S.K.3
Dickerson, R.E.4
Gerstein, M.5
Harvey, S.C.6
Heinemann, U.7
Lu, X.J.8
Neidle, S.9
Shakked, Z.10
-
48
-
-
26844489788
-
DNA as Helical Ruler: Exciton-Coupled Circular Dichroism in DNA Conjugates
-
Lewis, F. D.; Zhang, L. G.; Liu, X. Y.; Zuo, X. B.; Tiede, D. M.; Long, H.; Schatz, G. C. DNA as Helical Ruler: Exciton-Coupled Circular Dichroism in DNA Conjugates J. Am. Chem. Soc. 2005, 127, 14445-14453
-
(2005)
J. Am. Chem. Soc.
, vol.127
, pp. 14445-14453
-
-
Lewis, F.D.1
Zhang, L.G.2
Liu, X.Y.3
Zuo, X.B.4
Tiede, D.M.5
Long, H.6
Schatz, G.C.7
-
49
-
-
0035822717
-
Crystal Structure of a Polycyano-Polycadmate Host Clathrate Including a Charge-Transfer Complex of Methylviologen Dication and Mesitylene as a Guest
-
Yoshikawa, H.; Nishikiori, S.-i.; Suwinska, K.; Luboradzki, R.; Lipkowski, J. Crystal Structure of a Polycyano-Polycadmate Host Clathrate Including a Charge-Transfer Complex of Methylviologen Dication and Mesitylene as a Guest Chem. Commun. 2001, 1398-1399
-
(2001)
Chem. Commun.
, pp. 1398-1399
-
-
Yoshikawa, H.1
Nishikiori, S.-I.2
Suwinska, K.3
Luboradzki, R.4
Lipkowski, J.5
-
50
-
-
0002378236
-
Structure of Disodium Guanosine 5′-Phosphate Heptahydrate
-
Katti, S. K.; Seshadri, T. P.; Viswamitra, M. A. Structure of Disodium Guanosine 5′-Phosphate Heptahydrate Acta. Crystallogr. B 1981, 37, 1825-1831
-
(1981)
Acta. Crystallogr. B
, vol.37
, pp. 1825-1831
-
-
Katti, S.K.1
Seshadri, T.P.2
Viswamitra, M.A.3
-
51
-
-
4244110598
-
Structure of Disodium Guanosine 5′-Phosphate Heptahydrate
-
Barnes, C. L.; Hawkinson, S. W. Structure of Disodium Guanosine 5′-Phosphate Heptahydrate Acta. Crystallogr. B 1982, 38, 812-817
-
(1982)
Acta. Crystallogr. B
, vol.38
, pp. 812-817
-
-
Barnes, C.L.1
Hawkinson, S.W.2
-
53
-
-
33644897568
-
Hybrid Density Functional Theory for Pi-Stacking Interactions: Application to Benzenes, Pyridines, and DNA Bases
-
Waller, M. P.; Robertazzi, A.; Platts, J. A.; Hibbs, D. E.; Williams, P. A. Hybrid Density Functional Theory for Pi-Stacking Interactions: Application to Benzenes, Pyridines, and DNA Bases J. Comput. Chem. 2006, 27, 491-504
-
(2006)
J. Comput. Chem.
, vol.27
, pp. 491-504
-
-
Waller, M.P.1
Robertazzi, A.2
Platts, J.A.3
Hibbs, D.E.4
Williams, P.A.5
-
54
-
-
0001743059
-
7.12 - DNA Intercalators
-
Meth-Cohn, O. Barton, D. Nakanishi, K. Pergamon: Oxford
-
Wilson, W. D. 7.12-DNA Intercalators. In Comprehensive Natural Products Chemistry; Meth-Cohn, O.; Barton, D.; Nakanishi, K., Eds.; Pergamon: Oxford, 1999; pp 427-476.
-
(1999)
Comprehensive Natural Products Chemistry
, pp. 427-476
-
-
Wilson, W.D.1
-
55
-
-
43049141516
-
The M06 Suite of Density Functionals for Main Group Thermochemistry, Thermochemical Kinetics, Noncovalent Interactions, Excited States, and Transition Elements: Two New Functionals and Systematic Testing of Four M06-Class Functionals and 12 Other Functionals
-
Zhao, Y.; Truhlar, D. G. The M06 Suite of Density Functionals for Main Group Thermochemistry, Thermochemical Kinetics, Noncovalent Interactions, Excited States, and Transition Elements: Two New Functionals and Systematic Testing of Four M06-Class Functionals and 12 Other Functionals Theor. Chem. Acc. 2008, 120, 215-241
-
(2008)
Theor. Chem. Acc.
, vol.120
, pp. 215-241
-
-
Zhao, Y.1
Truhlar, D.G.2
-
56
-
-
84893169025
-
General Atomic and Molecular Electronic-Structure System
-
Schmidt, M. W.; Baldridge, K. K.; Boatz, J. A.; Elbert, S. T.; Gordon, M. S.; Jensen, J. H.; Koseki, S.; Matsunaga, N.; Nguyen, K. A.; Su, S. J. General Atomic and Molecular Electronic-Structure System J. Comput. Chem. 1993, 14, 1347-1363
-
(1993)
J. Comput. Chem.
, vol.14
, pp. 1347-1363
-
-
Schmidt, M.W.1
Baldridge, K.K.2
Boatz, J.A.3
Elbert, S.T.4
Gordon, M.S.5
Jensen, J.H.6
Koseki, S.7
Matsunaga, N.8
Nguyen, K.A.9
Su, S.J.10
-
57
-
-
84961980477
-
Quantum Mechanical Continuum Solvation Models
-
Tomasi, J.; Mennucci, B.; Cammi, R. Quantum Mechanical Continuum Solvation Models Chem. Rev. 2005, 105, 2999-3093
-
(2005)
Chem. Rev.
, vol.105
, pp. 2999-3093
-
-
Tomasi, J.1
Mennucci, B.2
Cammi, R.3
-
58
-
-
84962433811
-
Continuous and Smooth Potential Energy Surface for Conductorlike Screening Solvation Model Using Fixed Points with Variable Areas
-
Su, P. F.; Li, H. Continuous and Smooth Potential Energy Surface for Conductorlike Screening Solvation Model Using Fixed Points with Variable Areas J. Chem. Phys. 2009, 130, 074109
-
(2009)
J. Chem. Phys.
, vol.130
, pp. 074109
-
-
Su, P.F.1
Li, H.2
-
59
-
-
0034373424
-
Kohn-Sham Density Functional Theory: Predicting and Understanding Chemistry
-
Bickelhaupt, F. M.; Baerends, E. J. Kohn-Sham Density Functional Theory: Predicting and Understanding Chemistry Rev. Comput. Chem. 2000, 1-86
-
(2000)
Rev. Comput. Chem.
, pp. 1-86
-
-
Bickelhaupt, F.M.1
Baerends, E.J.2
-
60
-
-
20644438873
-
Chemistry with ADF
-
te Velde, G.; Bickelhaupt, F. M.; Baerends, E. J.; Guerra, C. F.; Van Gisbergen, S. J. A.; Snijders, J. G.; Ziegler, T. Chemistry with ADF J. Comput. Chem. 2001, 22, 931-967
-
(2001)
J. Comput. Chem.
, vol.22
, pp. 931-967
-
-
Te Velde, G.1
Bickelhaupt, F.M.2
Baerends, E.J.3
Guerra, C.F.4
Van Gisbergen, S.J.A.5
Snijders, J.G.6
Ziegler, T.7
-
61
-
-
0033465061
-
An Implementation of the Conductor-Like Screening Model of Solvation within the Amsterdam Density Functional Package
-
Pye, C. C.; Ziegler, T. An Implementation of the Conductor-Like Screening Model of Solvation within the Amsterdam Density Functional Package Theor. Chem. Acta 1999, 101, 396-408
-
(1999)
Theor. Chem. Acta
, vol.101
, pp. 396-408
-
-
Pye, C.C.1
Ziegler, T.2
-
62
-
-
84961980743
-
COSMO: A New Approach to Dielectric Screening in Solvents with Explicit Expressions for the Screening Energy and Its Gradient
-
Klamt, A.; Schuurmann, G. COSMO: A New Approach to Dielectric Screening in Solvents with Explicit Expressions for the Screening Energy and Its Gradient J. Chem. Soc. Perkin 2 1993, 799-805
-
(1993)
J. Chem. Soc. Perkin 2
, pp. 799-805
-
-
Klamt, A.1
Schuurmann, G.2
-
63
-
-
84961985847
-
Quantum Calculation of Molecular Energies and Energy Gradients in Solution by a Conductor Solvent Model
-
Barone, V.; Cossi, M. Quantum Calculation of Molecular Energies and Energy Gradients in Solution by a Conductor Solvent Model J. Phys. Chem. A 1998, 102, 1995-2001
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 1995-2001
-
-
Barone, V.1
Cossi, M.2
-
64
-
-
33747615553
-
-
See
-
Werner, H.-J.; Knowles, P. J.; Knizia, G.; Manby, F. R.; M. Schütz, MOLPRO, version 2010.1, a package of ab initio programs. See http://www.molpro.net.
-
MOLPRO, Version 2010.1, A Package of Ab Initio Programs
-
-
Werner, H.-J.1
Knowles, P.J.2
Knizia, G.3
Manby, F.R.4
Schütz, M.5
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