Bernard Pullman, Ph.D. - Publications

Affiliations: 
Universite de Paris, Paris, Île-de-France, France 
Area:
Theoretical Chemistry
Website:
http://en.wikipedia.org/wiki/Bernard_Pullman

176 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2009 Pullman B. A few considerations on quinones as antitumor agents International Journal of Quantum Chemistry. 30: 95-105. DOI: 10.1002/Qua.560300811  0.337
2009 Gresh N, Pullman B. A theoretical study of the selective entrapment of alkali and ammonium cations between guanine tetramers International Journal of Quantum Chemistry. 28: 49-56. DOI: 10.1002/Qua.560280707  0.7
2009 Corbin S, Lavery R, Pullman B. The molecular electrostatic potential of DNA: The effect of countercation screening on various allomorphic forms International Journal of Quantum Chemistry. 22: 103-110. DOI: 10.1002/Qua.560220711  0.571
2009 Pullman A, Pullman B. Electrostatic effect of the macromolecular structure on the biochemical reactivity of the nucleic acids. Significance for chemical carcinogenesis International Journal of Quantum Chemistry. 18: 245-259. DOI: 10.1002/Qua.560180724  0.518
2009 Mitra CK, Sarma RH, Giessner-Prettre C, Pullman B. Solution structure of DNA: The method of nuclear magnetic resonance spectroscopy International Journal of Quantum Chemistry. 18: 39-66. DOI: 10.1002/Qua.560180705  0.307
2009 Prado FR, Giessner-Prettre C, Pullman B. Ab initio quantum-mechanical calculations of the variation of the magnetic shielding constant of hydrogen and carbon 13 nuclei of the dimethylphosphate anion as a function of molecular conformation: A model study for nucleic acid constituents International Journal of Quantum Chemistry. 16: 491-501. DOI: 10.1002/Qua.560160735  0.342
2009 Lavery R, Pullman B. A theoretical model study of the mechanism of action of the enzyme glyoxylase I International Journal of Quantum Chemistry. 16: 467-474. DOI: 10.1002/Qua.560160732  0.478
2009 Lavery R, Oliveira MD, Pullman B. A preliminary theoretical study of the acid catalyzed hydration of glyoxal, methylglyoxal, and other simple aldehydes International Journal of Quantum Chemistry. 16: 459-466. DOI: 10.1002/Qua.560160731  0.517
2009 Langlet J, Claverie P, Pullman B, Piazzola D. Studies of solvent effects. IV. Study of hydration of the dimethyl phosphate anion (DMP−) and of the solvent effect upon its conformation International Journal of Quantum Chemistry. 16: 409-437. DOI: 10.1002/Qua.560160728  0.654
2009 Perahia D, Pullman A, Pullman B. Molecular electrostatic potential of the B-DNA helix. V. Poly(dG·dC) and poly(dA·dT) International Journal of Quantum Chemistry. 16: 353-363. DOI: 10.1002/Qua.560160723  0.552
2009 Kwiatkowski JS, Perahia D, Pullman B. Aspects of oxopyridine-water interactions International Journal of Quantum Chemistry. 14: 249-256. DOI: 10.1002/Qua.560140819  0.319
2009 Pullman B, Pullman A, Berthod H. SCF ab initio study of the “through-water” versus “direct” binding of the Na+ and Mg2+ cations to the phosphate anion International Journal of Quantum Chemistry. 14: 79-90. DOI: 10.1002/Qua.560140711  0.562
2009 Lavery R, Pullman A, Pullman B. Model quantum-chemical studies on the reaction between the candidate proximate carcinogen benzo(a)pyrene-7,8-dihydrodiol-9,10-epoxide and guanine International Journal of Quantum Chemistry. 14: 21-34. DOI: 10.1002/Qua.560140707  0.637
2009 Saran A, Mitra CK, Pullman B. Molecular orbital studies on nucleoside Antibiotics. I. Conformation of C-C linked antibiotics, formycin and showdomycin International Journal of Quantum Chemistry. 12: 43-54. DOI: 10.1002/Qua.560120706  0.363
2009 Pullman B, Berthod H, Courriere PH. The exploration of the conformational properties of biological phenethylamines by molecular orbital techniques International Journal of Quantum Chemistry. 8: 93-108. DOI: 10.1002/Qua.560080714  0.332
2009 Perahia D, Pullman B, Claverie P. Molecular orbital calculations on the conformation of polypeptides and proteins X. The conformational energy maps of the cysteinyl and methionyl residues International Journal of Quantum Chemistry. 6: 337-351. DOI: 10.1002/Qua.560060635  0.317
1995 Pullman A, Jortner J, Pullman B. Preface Molecular Engineering. 5: vii. DOI: 10.1007/BF00999572  0.366
1991 Hui X, Gresh N, Pullman B. Effect of side chains on the groove-binding specificity of anthraquinone intercalators International Journal of Quantum Chemistry. 40: 205-212. DOI: 10.1002/Qua.560400721  0.684
1990 Hui XW, Gresh N, Pullman B. Modelling of the binding specificity in the interactions of cationic porphyrins with DNA. Nucleic Acids Research. 18: 1109-14. PMID 2320411 DOI: 10.1093/Nar/18.5.1109  0.688
1989 Chen KX, Gresh N, Hui X, Pullman B, Zakrzewska K. Modelling basic features of specificity in DNA-aureolic acid-derived antibiotic interactions. Febs Letters. 245: 145-9. PMID 2924917 DOI: 10.1016/0014-5793(89)80209-1  0.672
1989 Gresh N, Pullman B, Arcamone F, Menozzi M, Tonani R. Joint experimental and theoretical investigation of the comparative DNA binding affinities of intercalating anthracycline derivatives. Molecular Pharmacology. 35: 251-6. PMID 2918856  0.678
1989 Hui XW, Gresh N, Pullman B. Modelling basic features of specificity in the binding of a dicationic steroid diamine to double-stranded oligonucleotides. Nucleic Acids Research. 17: 4177-87. PMID 2740214 DOI: 10.1093/Nar/17.11.4177  0.689
1988 Chen KX, Gresh N, Pullman B. Energetics and stereochemistry of DNA complexation with the antitumor AT specific intercalators tilorone and m-AMSA. Nucleic Acids Research. 16: 3061-73. PMID 3368315 DOI: 10.1093/Nar/16.7.3061  0.673
1987 Chen KX, Gresh N, Pullman B. Groove selectivity in the interaction of 9-aminoacridine-4-carboxamide antitumor agents with DNA. Febs Letters. 224: 361-4. PMID 3691795 DOI: 10.1016/0014-5793(87)80485-4  0.675
1987 Chen KX, Gresh N, Pullman B. A theoretical study of the intercalative binding of the anti-tumour drug anthrapyrazole to double-stranded oligonucleotides. Anti-Cancer Drug Design. 2: 79-84. PMID 3482353  0.689
1987 Zakrzewska K, Pullman B. Sequence selectivity, a test of the nature of the covalent adduct formed between benzo[a]pyrene and DNA. Journal of Biomolecular Structure & Dynamics. 4: 845-58. PMID 3152060 DOI: 10.1080/07391102.1987.10507682  0.334
1987 Chen KX, Gresh N, Pullman B. A tentative model of the intercalative binding of the neocarzinostatin chromophore to double-stranded tetranucleotides. Nucleic Acids Research. 15: 2175-89. PMID 2951653 DOI: 10.1093/Nar/15.5.2175  0.709
1987 Zakrzewska K, Lavery R, Pullman B. A theoretical study of the sequence specificity in binding of lexitropsins to B-DNA. Journal of Biomolecular Structure & Dynamics. 4: 833-43. PMID 2855924 DOI: 10.1080/07391102.1987.10507681  0.58
1987 Chen K, Gresh N, Pullman B. Intercalative binding and antitumor activity of bisantrene and derivatives International Journal of Quantum Chemistry. 32: 15-25. DOI: 10.1002/Qua.560320806  0.704
1987 Chen KX, Gresh N, Pullman B. A theoretical exploration of conformational aspects of ethidium bromide intercalation into a d(CpG)2 minihelix Biopolymers. 26: 831-848. DOI: 10.1002/Bip.360260605  0.726
1986 Chen KS, Gresh N, Pullman B. A theoretical investigation on the sequence selective binding of adriamycin to double-stranded polynucleotides. Nucleic Acids Research. 14: 2251-67. PMID 3960721 DOI: 10.1093/Nar/14.5.2251  0.681
1986 Zakrzewska K, Lavery R, Pullman B. Theoretical studies on the interaction of proteins and nucleic acid. II. The binding of alpha-helix to B-DNA. Biophysical Chemistry. 25: 201-13. PMID 3814753 DOI: 10.1016/0301-4622(86)87011-9  0.532
1986 Chen KX, Gresh N, Pullman B. A theoretical study of anthracene and phenanthrene derivatives acting as A-T specific intercalators. Nucleic Acids Research. 14: 9103-15. PMID 3786146 DOI: 10.1093/Nar/14.22.9103  0.692
1986 Chen KX, Gresh N, Pullman B. A theoretical study of the comparative binding affinities of daunomycin derivatives to a double-stranded oligomeric DNA. Proposal for new high affinity derivatives. Molecular Pharmacology. 30: 279-86. PMID 3748009  0.695
1986 Chen KX, Gresh N, Pullman B. A theoretical investigation on the sequence selective binding of mitoxantrone to double-stranded tetranucleotides. Nucleic Acids Research. 14: 3799-812. PMID 3714497 DOI: 10.1093/Nar/14.9.3799  0.684
1986 Gresh N, Pullman B. A theoretical study of the binding of phenothiazine derivatives to residues 82-93 of calmodulin. Molecular Pharmacology. 29: 355-62. PMID 3702854  0.698
1986 Zakrzewska K, Pullman B. Spermine-nucleic acid interactions: a theoretical study. Biopolymers. 25: 375-92. PMID 3634631 DOI: 10.1002/Bip.360250302  0.376
1986 Zakrzewska K, Pullman B. A theoretical investigation of the sequence specificity in the binding of the antitumor drug anthramycin to DNA. Journal of Biomolecular Structure & Dynamics. 4: 127-36. PMID 3271432 DOI: 10.1080/07391102.1986.10507650  0.386
1986 Lavery R, Zakrzewska K, Pullman B. Binding of non-intercalating antibiotics to B-DNA: a theoretical study taking into account nucleic acid flexibility. Journal of Biomolecular Structure & Dynamics. 3: 1155-70. PMID 3271428 DOI: 10.1080/07391102.1986.10508492  0.572
1986 Lavery R, Sklenar H, Zakrzewska K, Pullman B. The flexibility of the nucleic acids: (II). The calculation of internal energy and applications to mononucleotide repeat DNA. Journal of Biomolecular Structure & Dynamics. 3: 989-1014. PMID 3271422 DOI: 10.1080/07391102.1986.10508478  0.565
1986 Sklenar H, Lavery R, Pullman B. The flexibility of the nucleic acids: (I). "SIR", a novel approach to the variation of polymer geometry in constrained systems. Journal of Biomolecular Structure & Dynamics. 3: 967-87. PMID 3271421 DOI: 10.1080/07391102.1986.10508477  0.504
1986 Lavery R, Sklenar H, Pullman B. The flexibility of the nucleic acids: (III). The interaction of an aliphatic diamine, putrescine, with flexible B-DNA. Journal of Biomolecular Structure & Dynamics. 3: 1015-31. PMID 3271411 DOI: 10.1080/07391102.1986.10508479  0.578
1985 Furois-Corbin S, Pullman B. Specificity in carcinogen-DNA interaction: a theoretical exploration of the factors involved in the effect of neighboring bases on N-methyl-N-nitrosourea alkylation of DNA. Chemico-Biological Interactions. 54: 9-13. PMID 4017106 DOI: 10.1016/S0009-2797(85)80148-4  0.312
1985 Chen KX, Gresh N, Pullman B. A theoretical investigation on the sequence selective binding of daunomycin to double-stranded polynucleotides. Journal of Biomolecular Structure & Dynamics. 3: 445-66. PMID 3917031 DOI: 10.1080/07391102.1985.10508434  0.704
1985 Zakrzewska K, Pullman B. The effect of spermine binding on the reactivity of DNA towards carcinogenic alkylating agents. Journal of Biomolecular Structure & Dynamics. 3: 437-44. PMID 3917030 DOI: 10.1080/07391102.1985.10508433  0.357
1985 Lavery R, Pullman B. The dependence of the surface electrostatic potential of B-DNA on environmental factors. Journal of Biomolecular Structure & Dynamics. 2: 1021-32. PMID 3916934 DOI: 10.1080/07391102.1985.10507618  0.504
1985 Zakrzewska K, Pullman B. Theoretical exploration of netropsin binding to tRNA(Phe). Journal of Biomolecular Structure & Dynamics. 2: 737-43. PMID 2856019 DOI: 10.1080/07391102.1985.10506320  0.364
1984 Gresh N, Pullman B. A theoretical study of the nonintercalative binding of berenil and stilbamidine to double-stranded (dA-dT)n oligomers. Molecular Pharmacology. 25: 452-8. PMID 6727867  0.705
1984 Zakrzewska K, Lavery R, Pullman B. The solvation contribution to the binding energy of DNA with non-intercalating antibiotics. Nucleic Acids Research. 12: 6559-74. PMID 6089121 DOI: 10.1093/Nar/12.16.6559  0.518
1984 Gresh N, Pullman B. A theoretical study of the relative affinities of an aliphatic and an aromatic bisguanylhydrazone for the minor groove of double-stranded (dA-dT)n oligomers Theoretica Chimica Acta. 64: 383-395. DOI: 10.1007/Bf00548948  0.721
1984 Furois‐Corbin S, Pullman B, Lavery R. Effect of nucleic acid flexibility upon ASIF (accessible surface integrated field). Possible significance for biochemical reactivity exemplified by aflatoxin B1 binding International Journal of Quantum Chemistry. 26: 273-286. DOI: 10.1002/Qua.560260729  0.563
1983 Lavery R, Pullman A, Pullman B. The electrostatic field of the component units of DNA and its relationship to hydration. Biophysical Chemistry. 17: 75-86. PMID 6824764 DOI: 10.1016/0301-4622(83)87016-1  0.649
1983 Pullman B. Electrostatics of Polymorphic DNA. Journal of Biomolecular Structure & Dynamics. 1: 773-94. PMID 6400900 DOI: 10.1080/07391102.1983.10507481  0.368
1983 Zakrzewska K, Lavery R, Pullman B. Theoretical studies of the selective binding to DNA of two non-intercalating ligands: netropsin and SN 18071. Nucleic Acids Research. 11: 8825-39. PMID 6324104 DOI: 10.1093/Nar/11.24.8825  0.528
1983 Pullman A, Pullman B, Lavery R. Molecular electrostatic potential versus field. significance for DNA and its constituents. Journal of Molecular Structure: Theochem. 93: 85-91. DOI: 10.1016/0166-1280(83)80093-1  0.478
1983 Gresh N, Pullman B. Theoretical study of the interaction of tetramethylammonium with double-stranded oligonucleotides International Journal of Quantum Chemistry. 24: 491-507. DOI: 10.1002/Qua.560240506  0.686
1982 Lavery R, Pullman B. The electrostatic field of DNA: the role of the nucleic acid conformation. Nucleic Acids Research. 10: 4383-95. PMID 7122241 DOI: 10.1093/Nar/10.14.4383  0.558
1982 Lavery R, Pullman B, Zakrzewska K. Intrinsic electrostatic properties and base sequence effects in the structure of oligonucleotides. Biophysical Chemistry. 15: 343-51. PMID 7115887 DOI: 10.1016/0301-4622(82)80017-3  0.515
1982 Lavery R, Pullman B. The effects of countercation screening on the electrostatic potential of DNA. The rôle of the nucleic acid conformation. Febs Letters. 142: 271-4. PMID 7106290 DOI: 10.1016/0014-5793(82)80150-6  0.492
1982 Pullman B, Lavery R, Pullman A. Two aspects of DNA polymorphism and microheterogeneity: molecular electrostatic potential and steric accessibility. European Journal of Biochemistry / Febs. 124: 229-38. PMID 7094914 DOI: 10.1111/J.1432-1033.1982.Tb06582.X  0.67
1982 Corbin S, Lavery R, Pullman B. The molecular electrostatic potential and steric accessibility of double-helical A-RNA. Biochimica Et Biophysica Acta. 698: 86-92. PMID 6180767 DOI: 10.1016/0167-4781(82)90188-9  0.533
1982 Lavery R, Pullman A, Pullman B. The electrostatic field of B-DNA Theoretica Chimica Acta. 62: 93-106. DOI: 10.1007/Bf00581476  0.642
1981 Lavery R, Pullman B. The molecular electrostatic potential and steric accessibility of poly (dI.dC). Comparison with poly (dG.dC). Nucleic Acids Research. 9: 7041-51. PMID 7335499 DOI: 10.1093/Nar/9.24.7041  0.555
1981 Lavery R, Pullman B, Corbin S. The molecular electrostatic potential and steric accessibility of poly (dA-dT). poly (dA-dT) in various conformations: B-DNA, D-DNA and 'alternating-B' DNA. Nucleic Acids Research. 9: 6539-52. PMID 7322922 DOI: 10.1093/Nar/9.23.6539  0.557
1981 Lavery R, Pullman B. The molecular electrostatic potential and steric accessibility of A-DNA. Nucleic Acids Research. 9: 4677-88. PMID 7301586 DOI: 10.1007/Bf00549607  0.547
1981 Lavery R, Pullman B. The molecular electrostatic potential, steric accessibility and hydration of Dickerson's B-DNA dodecamer d(CpGpCpGpApApTpTpCpGpCpG). Nucleic Acids Research. 9: 3765-77. PMID 7279672 DOI: 10.1093/Nar/9.15.3765  0.568
1981 Pullman A, Pullman B. Molecular electrostatic potential of the nucleic acids. Quarterly Reviews of Biophysics. 14: 289-380. PMID 7027300 DOI: 10.1017/S0033583500002341  0.543
1981 Giessner-Prettre C, Ribas Prado F, Pullman B, Kan L, Kast JR, Ts'o PO. Computer programming for nucleic acid studies. II. Total chemical shifts calculation of all protons of double-stranded helices. Computer Programs in Biomedicine. 13: 167-83. PMID 6274583 DOI: 10.1016/0010-468X(81)90096-9  0.344
1981 Zakrzewska K, Lavery R, Pullman B. The electrostatic potential of a model phospholipid monolayer International Journal of Quantum Chemistry. 20: 161-170. DOI: 10.1002/Qua.560200714  0.53
1981 Pullman B, Pullman A. Structural factors involved in the binding of netropsin and distamycin A to nucleic acids Studia Biophysica. 86: 95-102.  0.474
1980 Zakrzewska K, Lavery R, Pullman A, Pullman B. The electrostatic potential and steric accessibility of reactive sites within Z-DNA. Nucleic Acids Research. 8: 3917-32. PMID 7443517 DOI: 10.1093/Nar/8.17.3917  0.665
1980 Gresh N, Pullman B. A theoretical study on the specificity of tetramethylammonium versus monomethylammonium binding to the active site of a phosphorylcholine antibody. Biochimica Et Biophysica Acta. 625: 356-67. PMID 7437471 DOI: 10.1016/0005-2795(80)90300-1  0.703
1980 Lavery R, Pullman A, Pullman B. The electrostatic molecular potential of yeast tRNAPhe. (I). The potential due to the phosphate backbone. Nucleic Acids Research. 8: 1061-79. PMID 7003554 DOI: 10.1093/Nar/8.5.1061  0.658
1980 Lavery R, Pullman A, Pullman B, de Oliveira M. The electrostatic molecular potential of tRNAPhe. IV. The potentials and steric accessibilities of sites associated with the bases. Nucleic Acids Research. 8: 5095-111. PMID 7003548 DOI: 10.1093/Nar/8.21.5095  0.655
1980 Gresh N, Pullman B. A theoretical study of the interaction of guanine and cytosine with specific amino acid side chains. Biochimica Et Biophysica Acta. 608: 47-53. PMID 6770903 DOI: 10.1016/0005-2787(80)90132-X  0.684
1980 Lavery R, Pullman A, Pullman B. The electrostatic molecular potential of yeast tRNA. (I). The potential due to the phosphate backbone Nucleic Acids Research. 8: 1061-1079. DOI: 10.1093/nar/8.5.1061  0.606
1980 Lavery R, Pullman A, Pullman B. The electrostatic molecular potential of yeast tRNAPhe. III. The molecular potential and the steric acessibility associated with the phosphate groups Theoretica Chimica Acta. 57: 233-243. DOI: 10.1007/Bf00554104  0.657
1980 Cauchy D, Lavery R, Pullman B. The effect of screening the electrostatic potentials of reactive sites within B-DNA by metal cations Theoretica Chimica Acta. 57: 323-327. DOI: 10.1007/Bf00552744  0.529
1980 Lavery R, Oliveira MD, Pullman B. The electrostatic potential of yeast tRNAPhe. II. The potentials of the phosphate groups in their various conformational states Journal of Computational Chemistry. 1: 301-306. DOI: 10.1002/Jcc.540010314  0.546
1979 Pullman B, Perahia D, Cauchy D. The molecular electrostatic potential of the B-DNA helix. VI. The regions of the base pairs in poly (dG.dC) and poly (dA.dT). Nucleic Acids Research. 6: 3821-9. PMID 493126 DOI: 10.1093/Nar/6.12.3821  0.347
1979 Gresh N, Pullman B. A theoretical study of the interaction of ammonium and guanidinium ions with the phosphodiester linkage Theoretica Chimica Acta. 52: 67-73. DOI: 10.1007/Bf00581702  0.675
1979 Perahia D, Pullman A, Pullman B. The molecular electrostatic potential of the B-DNA helix - III. The potential due to the sugar-phosphate backbone Theoretica Chimica Acta. 51: 349-357. DOI: 10.1007/Bf00548943  0.554
1979 Lavery R, Pullman B. The molecular electrostatic potential of the B-DNA helix - IV. C8 and amino sites of purines and the binding of carcinogenic acetylaminofluorene to DNA Theoretica Chimica Acta. 53: 175-181. DOI: 10.1007/Bf00548830  0.578
1979 Lavery R, Pullman B. Theoretical model study of the reactivity of benzo(a)pyrene diol epoxide with the amino groups of the nucleic acid bases International Journal of Quantum Chemistry. 16: 175-188. DOI: 10.1002/Qua.560160119  0.569
1979 Lavery R, Pullman B. Model quantum chemical studies of the electronic structure and aspects of reactivity of diol epoxides of aromatic hydrocarbons International Journal of Quantum Chemistry. 15: 271-280. DOI: 10.1002/Qua.560150303  0.559
1978 Prado FR, Giessner-Prettre C, Pullman B. On the conformational dependence of the proton chemical shifts in nucleosides and nucleotides. III. Proton chemical shifts of 5'-nucleotides as a function of different conformational parameters. Journal of Theoretical Biology. 74: 259-77. PMID 713576 DOI: 10.1016/0022-5193(78)90075-9  0.315
1978 Pohorille A, Perahia D, Pullman B. Molecular orbital studies on the conformations of 8-amino- and 8-dimethylaminoadenosine 5'-monophosphate. Biochimica Et Biophysica Acta. 517: 511-6. PMID 626749 DOI: 10.1016/0005-2787(78)90217-4  0.617
1978 Pullman A, Pullman B, Berthod H. An SCF ab initio investigation of the "through-water" interaction of the phosphate anion with the Na+ cation Theoretica Chimica Acta. 47: 175-192. DOI: 10.1007/Bf00577160  0.554
1978 Caillet J, Claverie P, Pullman B. Effect of the crystalline environment upon the rotational conformation about the N-C and C-C′ bonds (Φ and Ψ) in amides and peptides Theoretica Chimica Acta. 47: 17-26. DOI: 10.1007/Bf00554693  0.716
1978 Demoulin D, Armbruster AM, Pullman B. A quantum-mechanical study of the interaction of glyoxal with guanine Theoretica Chimica Acta. 48: 143-153. DOI: 10.1007/Bf00552496  0.335
1978 Lavery R, Pullman A, Pullman B. On the relative acidity and basicity of the amino groups of the nucleic acid bases Theoretica Chimica Acta. 50: 67-73. DOI: 10.1007/Bf00552495  0.645
1978 Goldblum A, Pullman B. Study of anion binding to protonated nucleic acid bases using electrostatic molecular potentials Theoretica Chimica Acta. 47: 345-347. DOI: 10.1007/Bf00549263  0.35
1978 Claverie P, Daudey JP, Langlet J, Pullman B, Piazzola D, Huron MJ. Studies of solvent effects. 1. Discrete, continuum, and discrete-continuum models and their comparison for some simple cases: NH4 +, CH3OH, and substituted NH4 + Journal of Physical Chemistry. 82: 405-418.  0.761
1977 Giessner-Prettre C, Prado FR, Pullman B. A theoretical study oh the effect of "bound" water on the proton chemical shifts of the nucleic acid bases. Nucleic Acids Research. 4: 3229-38. PMID 909804 DOI: 10.1093/Nar/4.9.3229  0.353
1977 Pullman B, Goldblum A, Berthod H. Anion binding to nucleic acid bases. A quantum-mechanical exploration using electrostatic molecular potentials. Biochemical and Biophysical Research Communications. 77: 1166-9. PMID 901528 DOI: 10.1016/S0006-291X(77)80101-0  0.391
1977 Giessner-Prettre C, Pullman B, Caillet J. Theoretical study on the proton chemical shifts of hydrogen bonded nucleic acid bases. Nucleic Acids Research. 4: 99-116. PMID 866180 DOI: 10.1093/Nar/4.1.99  0.348
1977 Giessner-Prettre C, Pullman B. On the conformational dependence of the proton chemical shifts in nucleosides and nucleotides. II. Proton shifts in the ribose ring of purine nucleosides as a function of the torsion angle about the glycosyl bond. Journal of Theoretical Biology. 65: 189-201. PMID 850419 DOI: 10.1016/0022-5193(77)90083-2  0.33
1977 Caillet J, Claverie P, Pullman B. On the conformational varieties of 5‐methoxy‐N,N‐dimethyltryptamine and serotonin in crystalline environment Acta Crystallographica Section A. 33: 885-889. DOI: 10.1107/S0567739477002186  0.689
1977 Perahia D, Pullman A, Pullman B. Cation-binding to biomolecules - IV. An ab initio study on the interaction of Na+ with the purine and pyrimidine bases of the nucleic acids Theoretica Chimica Acta. 43: 207-214. DOI: 10.1007/Bf00551546  0.568
1977 Pullman B, Gresh N, Berthod H, Pullman A. Cation binding to biomolecules - V. Binding of alkali and alkaline-earth cations to the phosphate group Conformational effects on the phosphodiester linkage and the polar head of phospholipids Theoretica Chimica Acta. 44: 151-163. DOI: 10.1007/Bf00549098  0.759
1977 Langlet J, Claverie P, Pullman B, Piazzola D, Daudey JP. Studies of solvent effects - III. Solvent effect on the conformation of acetylcholine Theoretica Chimica Acta. 46: 105-116. DOI: 10.1007/Bf00548086  0.782
1976 Perahia D, Pullman B. Molecular orbital calculations on the conformation of phosphodiesters. An extended correlation between the geometry and the conformation of the phosphate group. Biochimica Et Biophysica Acta. 435: 282-9. PMID 949497 DOI: 10.1016/0005-2787(76)90109-X  0.315
1976 Pullman B, Saran A. Quantum-mechanical studies on the conformation of nucleic acids and their constituents. Progress in Nucleic Acid Research and Molecular Biology. 18: 215-322. PMID 790473 DOI: 10.1016/S0079-6603(08)60589-9  0.373
1976 Perahia D, Pullman A, Pullman B. Cation-binding to biomolecules - II. An ab initio study on the interaction of Mg2+ with uracil Theoretica Chimica Acta. 42: 23-31. DOI: 10.1007/Bf00548288  0.543
1975 Pullman B, Berthod H, Gresh N. [The hydration of acetylcholine and its conformation in solution]. Comptes Rendus Hebdomadaires Des SéAnces De L'AcadéMie Des Sciences. SéRie D: Sciences Naturelles. 280: 1741-4. PMID 807368  0.675
1975 Kwiatkowski JS, Pullman B. Taulomerism and Electronic Structure of Biological Pyrimidines Advances in Heterocyclic Chemistry. 18: 199-335. DOI: 10.1016/S0065-2725(08)60131-2  0.316
1975 Pullman B, Berthod H, Gresh N. Quantum-mechanical studies on the conformation of phospholipids. the effect of water on the conformational properties of the polar head Febs Letters. 53: 199-204. DOI: 10.1016/0014-5793(75)80019-6  0.678
1975 Pullman B, Pullman A, Berthod H, Gresh N. Quantum-mechanical studies of environmental effects on biomolecules VI. Ab initio Studies on the hydration scheme of the phosphate group Theoretica Chimica Acta. 40: 93-111. DOI: 10.1007/Bf01135881  0.745
1975 Maigret B, Pullman B. Quantum mechanical study of the conformation of valinomycin and its constituents | Etudes quantiques sur la conformation de la valinomycine et de ses éléments constitutifs Theoretica Chimica Acta. 37: 17-36. DOI: 10.1007/Bf00549768  0.305
1975 Pullman B, Berthod H. Molecular orbital studies on the conformation of GABA (γ-aminobutyric acid) - The isolated molecule and the solvent effect Theoretica Chimica Acta. 36: 317-328. DOI: 10.1007/Bf00549695  0.36
1975 Pullman B, Gresh N, Berthod H. Binding of cations and the conformation of the phosphodiester linkage Theoretica Chimica Acta. 40: 71-74. DOI: 10.1007/Bf00547914  0.707
1974 Saran A, Pullman B, Perahia D. Molecular orbital calculations on the conformation of nucleic acids and their constituents. X. Conformation of beta-D-arabinosyl nucleosides. Biochimica Et Biophysica Acta. 349: 189-203. PMID 4836353 DOI: 10.1016/0005-2787(74)90080-X  0.329
1974 Perahia D, Pullman B, Saran A. Molecular orbital calculations on the conformation of nucleic acids and their constituents. XI. The backbone structure of (3'-5') and (2'-5')-linked diribose monophosphates with different sugar puckers. Biochimica Et Biophysica Acta. 353: 16-27. PMID 4835379 DOI: 10.1016/0005-2787(74)90093-8  0.343
1974 Perahia D, Pullman B, Saran A. Molecular orbital calculations on the conformation of nucleic acids and their constituents. IX. The geometry of the phosphate group: key to the conformation of polynucleotides? Biochimica Et Biophysica Acta. 340: 299-313. PMID 4826257 DOI: 10.1016/0005-2787(74)90275-5  0.354
1974 Pullman A, Pullman B. New paths in the molecular orbital approach to solvation of biological molecules. Quarterly Reviews of Biophysics. 7: 505-66. PMID 4617235 DOI: 10.1017/S0033583500001529  0.514
1974 Pullman B, Pullman A. Molecular orbital calculations on the conformation of amino acid residues of proteins. Advances in Protein Chemistry. 28: 347-526. PMID 4598825 DOI: 10.1016/S0065-3233(08)60233-8  0.484
1974 Pullman B, Courrière P, Berthod H. Molecular orbital studies on the conformation of hallucinogenic indolealkylamines and related compounds. The isolated molecules and the solvent effect. Journal of Medicinal Chemistry. 17: 439-47. PMID 4524607 DOI: 10.1002/Chin.197435242  0.31
1974 Maigret B, Pullman B. Molecular orbital calculations on the conformation of polypeptides and proteins - XI. Conformational studies on "tripeptide" models Theoretica Chimica Acta. 35: 113-128. DOI: 10.1007/Bf00551399  0.332
1973 Saran A, Berthod H, Pullman B. Molecular orbital calculations on the conformation of nucleic acids and their constituents. 8. Conformations of 2',3'- and 3',5'-cyclic nucleotides. Biochimica Et Biophysica Acta. 331: 154-64. PMID 4774406 DOI: 10.1016/0005-2787(73)90429-2  0.344
1973 Giessner-Prettre C, Pullman B. Molecular orbital calculations of the proton-proton coupling constants in nucleosides. Journal of Theoretical Biology. 40: 441-54. PMID 4754891 DOI: 10.1016/0022-5193(73)90003-9  0.325
1973 Saran A, Pullman B, Perahia D. Molecular orbital calculations on the conformation of nucleic acids and their constituents. VI. Conformation about the exocyclic C(4')-C(5') bond in alpha-nucleosides. Biochimica Et Biophysica Acta. 299: 497-9. PMID 4541048 DOI: 10.1016/0005-2787(73)90220-7  0.35
1973 Pullman B, Courrière P. Complementary molecular orbital investigations on the conformation of choline derivatives Theoretica Chimica Acta. 31: 19-37. DOI: 10.1007/Bf00527436  0.382
1973 SARAN A, PERAHIA D, PULLMAN B. ChemInform Abstract: MOLECULAR ORBITAL CALCULATIONS ON THE CONFORMATION OF NUCLEIC ACIDS AND THEIR CONSTITUENTS PART 7, CONFORMATION OF THE SUGAR RING IN BETA-NUCLEOSIDES, THE PSEUDOROTATIONAL REPRESENTATION Chemischer Informationsdienst. 4. DOI: 10.1002/Chin.197337087  0.331
1972 Saran A, Pullman B, Perahia D. Molecular orbital studies on the conformation of the terminal aminoacyladenosine moieties of tRNA. Febs Letters. 23: 332-336. PMID 11946646 DOI: 10.1016/0014-5793(72)80309-0  0.326
1972 Perahia D, Pullman B, Saran A. A molecular orbital probe into the conformation of ATP. Biochemical and Biophysical Research Communications. 47: 1284-9. PMID 5040235 DOI: 10.1016/0006-291X(72)90212-4  0.33
1971 Maigret B, Pullman B, Perahia D. Molecular orbital calculations on the conformation of polypeptides and proteins. VII. Refined calculations on the alanyl residue. Journal of Theoretical Biology. 31: 269-85. PMID 5557079 DOI: 10.1016/0022-5193(71)90187-1  0.372
1971 Maigret B, Perahia D, Pullman B. Molecular orbital calculations on the conformation of polypeptides and proteins. V. Conformational energy maps and stereochemical rotational states of aliphatic residues. Biopolymers. 10: 491-511. PMID 5552657 DOI: 10.1002/Bip.360100306  0.359
1971 Caillet J, Pullman B, Maigret B. Molecular orbital calculations on the folding of cyclic dipeptides with aromatic and aliphatic side chains. Biopolymers. 10: 221-4. PMID 5544942 DOI: 10.1002/Bip.360100114  0.305
1971 Berthod H, Pullman B. Molecular orbital calculations on the conformation of nucleic acids and their constituents. II. Conformational energies of nucleosides with C(3')-and C(2')-exo sugars. Biochimica Et Biophysica Acta. 246: 359-64. PMID 5316821 DOI: 10.1016/0005-2787(71)90772-6  0.361
1971 Maigret B, Perahia D, Pullman B. Molecular orbital calculations on the conformation of polypeptides and proteins. 8. The conformational energy maps and stereochemical rotational states of the asparaginyl, glutaminyl aspartyl and glutamyl residues. Biopolymers. 10: 1649-60. PMID 5126131 DOI: 10.1002/Bip.360100918  0.346
1971 Berthod H, Pullman B. Molecular orbital calculations on the conformation of nucleic acids and their constituents. I. Conformational energies of beta-nucleosides with C(3')-and C(2')-endo sugars. Biochimica Et Biophysica Acta. 232: 595-606. PMID 4326669 DOI: 10.1016/0005-2787(71)90750-7  0.317
1971 Pullman B, Pullman A. Electronic Aspects of Purine Tautomerism Advances in Heterocyclic Chemistry. 13: 77-159. DOI: 10.1016/S0065-2725(08)60349-9  0.522
1971 Pullman B, Coubeils JL, Courriere P, Perahia D. Molecular orbital calculations on the conformation of polypeptides and proteins - IX. The conformational energy maps of the lysyl and arginyl residues Theoretica Chimica Acta. 22: 11-22. DOI: 10.1007/Bf00527230  0.325
1970 Maigret B, Pullman B, Dreyfus M. Molecular orbital calculations on the conformation of polypeptides and proteins. I. Preliminary investigations and simple dipeptides. Journal of Theoretical Biology. 26: 321-33. PMID 5434350 DOI: 10.1016/S0022-5193(70)80021-2  0.379
1970 Giessner-Prettre C, Pullman B. Intermolecular nuclear shielding values for protons of purines and flavins. Journal of Theoretical Biology. 27: 87-95. PMID 5419910 DOI: 10.1016/0022-5193(70)90130-X  0.318
1970 Langlet J, Pullman B, Berthod H. Étude quantique de l'isomérisation s-cis-s-trans de l'anneau cyclohexéne par rapport à la chaîne polyénique dans le rétinal et l'acide β-ionylidène crotonique Journal of Molecular Structure. 6: 139-144. DOI: 10.1016/0022-2860(70)87006-5  0.6
1970 Perahia D, Maigret B, Pullman B. Molecular orbital calculations on the conformation of polypeptides and proteins - VI. The conformational energy maps and stereochemical rotational states of the seryl and threonyl residues Theoretica Chimica Acta. 19: 121-134. DOI: 10.1007/Bf01185857  0.318
1970 Pullman B, Maigret B, Perahia D. Molecular orbital calculations on the conformation of polypeptides and proteins - III. Conformational maps of amino-acid residues: A preliminary comparison of empirical, quantum-mechanical and experimental results Theoretica Chimica Acta. 18: 44-56. DOI: 10.1007/Bf00533696  0.336
1970 Caillet J, Pullman B. Quantum-mechanical studies on the conformational and electronic properties of steroids - I. The sterane (perhydrocyclopentanophenanthrene) ring system and its constituent subunits Theoretica Chimica Acta. 17: 377-383. DOI: 10.1007/Bf00528573  0.328
1970 LANGLET J, PULLMAN B, BERTHOD H. ChemInform Abstract: ELEKTRONENSTRUKTUR VON RETINAL UND SEINEN CIS-ISOMEREN 3. MITT. STRUKTUR DES 11CIS-ISOMEREN BEI EINBEZIEHUNG ALLER VALENZELEKTRONEN Chemischer Informationsdienst. Organische Chemie. 1: no-no. DOI: 10.1002/Chin.197034153  0.579
1970 LANGLET J, PULLMAN B, BERTHOD H. ChemInform Abstract: ELEKTRONENSTRUKTUR VON RETINAL UND SEINEN CIS-ISOMEREN 2. MITT. UMWANDLUNG VON ALL-TRANS-RETINAL IN SEINE ISOMEREN 9CIS,11CIS UND 13CIS Chemischer Informationsdienst. Organische Chemie. 1: no-no. DOI: 10.1002/Chin.197012030  0.577
1969 Pullman B, Langlet J, Berthod H. On the S-cis-S-trans isomerism of the cyclohexene ring with respect to the polyene chain in retinals, carotenoids, vitamins A and related compounds. Journal of Theoretical Biology. 23: 492-5. PMID 5806627 DOI: 10.1016/0022-5193(69)90034-4  0.596
1969 Pullman B, Pullman A. Quantum-mechanical investigations of the electronic structure of nucleic acids and their constituents. Progress in Nucleic Acid Research and Molecular Biology. 9: 327-402. PMID 4305447 DOI: 10.1016/S0079-6603(08)60772-2  0.442
1969 Langlet J, Pullman B, Berthod H. Structure électronique du rétinal et de ses isomères CIS Journal De Chimie Physique. 66: 1616-1623. DOI: 10.1051/Jcp/196966S21616  0.59
1968 Pullman B, Berthod H, Langlet J. [On the tautomerism of purine and pyrimidine bases bringing in play the proton of the glycosides nitrogens]. Comptes Rendus Hebdomadaires Des SéAnces De L'AcadéMie Des Sciences. SéRie D: Sciences Naturelles. 266: 1063-5. PMID 4969196  0.576
1968 Jordan F, Pullman B. Extended Hückel calculations on the conformation and structure of thymine photodimers Theoretical Chemistry Accounts. 10: 423-434. DOI: 10.1007/Bf00528773  0.533
1967 Pullman B, Claverie P, Caillet J. Interaction energies in hydrogen-bonded purine-pyrimidine triplets. Proceedings of the National Academy of Sciences of the United States of America. 57: 1663-9. PMID 5231401 DOI: 10.1073/Pnas.57.6.1663  0.716
1967 Pullman A, Pullman B. Quantum Biochemistry Comprehensive Biochemistry. 22: 1-60. DOI: 10.1016/B978-1-4831-9712-8.50009-6  0.459
1966 Pullman B, Claverie P, Caillet J. On the exclusivity of hydrogen-bonded pairing between the Watson-Crick complementary bases Journal of Molecular Biology. 22: 373-375. PMID 5972773 DOI: 10.1016/0022-2836(66)90141-0  0.688
1966 Claverie P, Pullman B, Caillet J. Van der Waals-London interactions between stacked purines and pyrimidines. Journal of Theoretical Biology. 12: 419-34. PMID 5965768  0.695
1966 Pullman B, Claverie P, Caillet J. Van der Waals-London interactions and the configuration of hydrogen-bonded purine and pyrimidine pairs. Proceedings of the National Academy of Sciences of the United States of America. 55: 904-12. PMID 5219699 DOI: 10.1073/Pnas.55.4.904  0.718
1966 Pullman B, Claverie P, Caillet J. [On the role of Van der Waals-London forces in the interactions between the purine and pyrimidine bases]. Comptes Rendus Hebdomadaires Des SéAnces De L'AcadéMie Des Sciences. SéRie D: Sciences Naturelles. 263: 2006-9. PMID 4963935  0.685
1965 PULLMAN B, CLAVERIE P, CAILLET J. INTERMOLECULAR FORCES IN ASSOCIATION OF PURINES WITH POLYBENZENOID HYDROCARBONS. Science (New York, N.Y.). 147: 1305-7. PMID 14250326  0.689
1965 Veillard A, Pullman B. [Additional material on the electronic structure of biological ferroporphyrins]. Journal of Theoretical Biology. 8: 317-26. PMID 5876242  0.446
1965 Veillard A, Pullman B. [Aspects of the electronic structure of vitamin B12 and of its analogs]. Journal of Theoretical Biology. 8: 307-16. PMID 5876241  0.456
1965 Pullman B, Claverie P, Caillet J. [On the association of purine and pyrimidine bases in solution]. Comptes Rendus Hebdomadaires Des SéAnces De L'AcadéMie Des Sciences. SéRie D: Sciences Naturelles. 260: 5387-9. PMID 4954002  0.662
1965 Pullman B, Claverie P, Caillet J. [On the mechanism of molecular interactions in solution between aromatic hydrocarbons and purine and pyrimidine bases]. Comptes Rendus Hebdomadaires Des SéAnces De L'AcadéMie Des Sciences. SéRie D: Sciences Naturelles. 260: 5915-7. PMID 4953974  0.701
1963 PULLMAN A, PULLMAN B. ON THE MECHANISM OF ULTRAVIOLET-INDUCED MUTATIONS. Biochimica Et Biophysica Acta. 75: 269-71. PMID 14083909  0.383
1963 VEILLARD A, PULLMAN B. [On the incorporation of purine bases into vitamin B12 analogs]. Comptes Rendus Hebdomadaires Des SéAnces De L'AcadéMie Des Sciences. 257: 291-3. PMID 13996553  0.447
1963 Veillard A, Pullman B. [Study using the self-consistent molecular field method of the electronic structure of purine and pyrimidine bases of biochemical value]. Journal of Theoretical Biology. 4: 37-51. PMID 4289947  0.47
1961 PULLMAN A, PULLMAN B. The band structure of melanins. Biochimica Et Biophysica Acta. 54: 384-5. PMID 14489199 DOI: 10.1016/0006-3002(61)90389-4  0.461
1961 SUARD M, BERTHIER G, PULLMAN B. [On the electronic states of proteins]. Biochimica Et Biophysica Acta. 52: 254-65. PMID 13918075 DOI: 10.1016/0006-3002(61)90675-8  0.631
1961 VEILLARD A, PULLMAN B, BERTHIER G. [Theoretical research on the diamagnetic anisotropy of conjugated molecules of biological interest]. Comptes Rendus Hebdomadaires Des SéAnces De L'AcadéMie Des Sciences. 252: 2321-2. PMID 13780596  0.697
1961 PULLMAN A, PULLMAN B. The cis-trans isomerization of conjugated polyenes and the occurrence of a hindered cis-isomer of retinene in the rhodopsin system. Proceedings of the National Academy of Sciences of the United States of America. 47: 7-14. PMID 13738465 DOI: 10.1073/Pnas.47.1.7  0.476
1960 Pullman B, Spanjaard C, Berthier G. FEATURES OF THE ELECTRONIC STRUCTURE OF THE IRON-PORPHYRIN COMPLEXES WITH SPECIAL REFERENCE TO THE OXIDO-REDUCTIVE PROPERTIES OF CYTOCHROMES. Proceedings of the National Academy of Sciences of the United States of America. 46: 1011-20. PMID 16590707 DOI: 10.1073/Pnas.46.8.1011  0.61
1960 Pullman B, Pullman A. Some electronic aspects of biochemistry Reviews of Modern Physics. 32: 428-436. DOI: 10.1103/Revmodphys.32.428  0.466
1959 Pullman A, Pullman B. ELEMENTS OF A GENERAL THEORY OF ENZYMATIC HYDROLYSIS. Proceedings of the National Academy of Sciences of the United States of America. 45: 1572-82. PMID 16590546 DOI: 10.1073/Pnas.45.11.1572  0.459
1959 Pullman B, Pullman A. THE ELECTRONIC STRUCTURE OF THE RESPIRATORY COENZYMES. Proceedings of the National Academy of Sciences of the United States of America. 45: 136-44. PMID 16590361 DOI: 10.1073/Pnas.45.2.136  0.479
1959 PULLMAN B, PULLMAN A. The oxido-reductive properties of organic dyes of biological importance. Biochimica Et Biophysica Acta. 35: 535-7. PMID 14435304  0.404
1959 PULLMAN B, PULLMAN A. The electronic structure of the purine-pyrimidine pairs of DNA. Biochimica Et Biophysica Acta. 36: 343-50. PMID 14435303 DOI: 10.1016/0006-3002(59)90176-3  0.557
1958 Pullman B, Pullman A. ELECTRON-DONOR AND -ACCEPTOR PROPERTIES OF BIOLOGICALLY IMPORTANT PURINES, PYRIMIDINES, PTERIDINES, FLAVINS, AND AROMATIC AMINO ACIDS. Proceedings of the National Academy of Sciences of the United States of America. 44: 1197-202. PMID 16590332 DOI: 10.1073/Pnas.44.12.1197  0.509
1955 PULLMAN A, PULLMAN B. Electronic structure and carcinogenic activity of aromatic molecules; new developments. Advances in Cancer Research. 3: 117-69. PMID 13248740  0.436
1955 Pullman B, Berthier G. Le pouvoir de conjugaison des carbones aromatiques et l’effet bathochrome des méthyles Journal De Chimie Physique. 52: 114-118. DOI: 10.1051/Jcp/1955520114  0.627
1952 Berthier G, Pullman B, Pontis J. Recherches théoriques sur les constantes de force et les fréquences de vibration du groupement carbonyle dans les molécules organiques conjuguées Journal De Chimie Physique. 49: 367-376. DOI: 10.1051/Jcp/1952490367  0.634
1950 PULLMAN A, BERTHIER G, PULLMAN B. [Energetic characteristics of carcinogenic hydrocarbons]. Acta - Unio Internationalis Contra Cancrum. 7: 140-8. PMID 14789598  0.686
1949 Pullman A, Pullman B. Caractères principaux de la structure électronique de divers systèmes organiques conjugués Journal De Chimie Physique. 46: 212-234. DOI: 10.1051/Jcp/1949460212  0.481
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