Albert E. Pullman

Albert E. Pullman's AcademicInfluence.com Rankings

Albert E. Pullman

Chemistry

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#3212

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Physical Chemistry

#250

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#291

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Chemistry

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Albert E. Pullman's Published Works

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Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author

Published Works

Molecular electrostatic potential of the nucleic acids (1981) (319)
Electronic structure and carcinogenic activity of aromatic molecules; new developments. (1955) (252)
A non-empirical study of the hydrogen bond between peptide units (1970) (178)
Molecular orbital calculations on the conformation of amino acid residues of proteins. (1974) (158)
The molecular electrostatic potentials for the nucleic acid bases: Adenine, thymine, and cytosine (1972) (137)
Improvements of the continuum model. 1. Application to the calculation of the vaporization thermodynamic quantities of nonassociated liquids (1988) (126)
Molecular electrostatic potentials: Comparison of ab initio and CNDO results (1972) (123)
Electronic Aspects of Purine Tautomerism (1971) (119)
Large Finite Systems (1987) (115)
Theoretical studies of molecular conformation. Derivation of an additive procedure for the computation of intramolecular interaction energies. Comparison withab initio SCF computations (1984) (112)
Theoretical study of the electronic properties of the purine and pyrimidine components of the nucleic acids (1966) (108)
New Paths in the Molecular Orbital Approach to Solvation of Biological Molecules (1974) (107)
Quantum‐mechanical studies of environmental effects on biomolecules II. Hydration sites in purines and pyrimidines (1973) (102)
Some Electronic Aspects of Biochemistry (1960) (96)
Ab initio Calculations on cytosine, thymine and adenine (1969) (93)
ELECTRON-DONOR AND -ACCEPTOR PROPERTIES OF BIOLOGICALLY IMPORTANT PURINES, PYRIMIDINES, PTERIDINES, FLAVINS, AND AROMATIC AMINO ACIDS. (1958) (93)
Hydration scheme of uracil and cytosine (1978) (87)
Water and Ions in Biological Systems (1985) (84)
N- versus O-proton affinities of the amide group: Ab initio electrostatic molecular potentials (1972) (83)
The band structure of melanins. (1961) (80)
The electronic structure of the purine-pyrimidine pairs of DNA. (1959) (78)
Success of the PCILO method and failure of the CNDO/2 method for predicting conformations in some conjugated systems (1973) (77)
An abinitio quantum-mechanical investigation on the rotational isomerism in amides and esters. (2009) (75)
Aspects of the Electronic Structure of the Purine and Pyrimidine Bases of the Nucleic Acids and of Their Interactions (1968) (75)
Intermolecular interactions: Elaboration on an additive procedure including an explicit charge-transfer contribution (1986) (74)
Optimized monopole expansions for the representation of the electrostatic properties of the nucleic acids (1984) (72)
A non-empirical study of hydrogen bonding in the dimer of formamide (1970) (72)
Modelling of Biomolecular Structures and Mechanisms (1995) (67)
Transport Through Membranes: Carriers, Channels and Pumps (1988) (67)
Ab initio molecular electrostatic potentials (1975) (66)
Ab initio investigation of the energy and electronic evolution upon progressive solvation of ammonium ions (1975) (65)
All valence-electrons calculations of the biological purines and pyrimidines (1968) (64)
Quantum-mechanical studies of environmental effects on biomolecules VI.Ab initio Studies on the hydration scheme of the phosphate group (1975) (63)
Theoretical study of the electronic properties of biological purines and pyrimidines. II. The effect of configuration mixing (1967) (62)
Hydrogen bonding in pure and aqueous formamide (1978) (61)
Quantum-mechanical investigations of the electronic structure of nucleic acids and their constituents. (1969) (60)
Cation-binding to biomolecules (1976) (58)
THE ELECTRONIC STRUCTURE OF THE RESPIRATORY COENZYMES. (1959) (55)
Quantum mechanical studies of environmental effects on biomolecules. An ab initio study of the hydration of dimethylphosphate (1975) (52)
Membrane Proteins: Structures, Interactions and Models (1992) (50)
An ab initio study of the hydration of alkylammonium groups (1973) (50)
An ab initio study of the effect of the 3d orbitals of phosphorus on the properties of the phosphate group (1975) (49)
Steric accessibility of reactive centers in B‐DNA (1981) (48)
Use of the overlap multipole expansion for approximating molecular electrostatic potentials (1979) (48)
The effect of σ and π singly-excited configurations in the calculation of excited states by the CNDO and INDO approximations (1969) (47)
SCF ab initio molecular orbital study on the relative affinities of peptide and ester carbonyl groups for Na+ and K+ ions (1973) (47)
SCF AB initio study of the protonation of the peptide bond (1973) (47)
Two aspects of DNA polymorphism and microheterogeneity: molecular electrostatic potential and steric accessibility. (2005) (47)
Optimized monopole expansions for the representation of the electrostatic properties of polypeptides and proteins (1985) (46)
Cation binding to biomolecules (1977) (44)
Electronic Delocalization and Biochemical Evolution (1962) (43)
Energy profiles in the gramicidin A channel (1987) (43)
Cation binding to "crown" ethers: An ab initio model study (1975) (42)
A new theoretical index of biochemical reactivity combining steric and electrostatic factors. An application to yeast tRNAPhe. (1984) (41)
Molecular electrostatic potential of the B-DNA helix. I. Region of the guanine–cytosine base pair (1979) (41)
The molecular electrostatic potential of the dimethyl phosphate anion: An ab initio study (1975) (41)
On the calculation of molecular dipole moments (1968) (41)
Theoretical study of the electronic properties of biological purines and pyrimidines (1967) (40)
P-quinodimethane and its diradical (1947) (40)
The gramicidin A channel: the energy profile for single and double occupancy in a head‐to‐head β6.3 3,3‐helical dimer backbone (1983) (40)
The gramicidin A channel: comparison of the energy profiles of Na+, K+ and Cs+ (1984) (40)
A possible model for the inner wall of the acetylcholine receptor channel. (1989) (39)
Quantum mechanical studies of environmental effects on biomolecules (1974) (39)
Cation-binding to biomolecules (1977) (38)
Quantum mechanical studies of environmental effects on biomolecules (1979) (38)
Theoretical studies of molecular conformation. II: Application of the SIBFA procedure to molecules containing carbonyl and carboxylate oxygens and amide nitrogens (1985) (37)
Hydration scheme of the complementary base-pairs of DNA. (1978) (37)
The gramicidin A channel (1984) (37)
Anab initio theoretical study of the binding of ZnII with biologically significant ligands: CO2, H2O, OH−, imidazole, and imidazolate (1978) (37)
An SCFab initio investigation of the “through-water” interaction of the phosphate anion with the Na+ cation (1978) (37)
On the affinity of cytosine towards electrophiles (1977) (35)
On the molecular electrostatic potentials obtained with CNDO and INDO wave functions (1974) (35)
Computations of intermolecular interactions: Expansion of a charge-transfer energy contribution in the framework of an additive procedure. Applications to hydrogen-bonded systems (1982) (34)
On the molecular electrostatic potentials obtained from CNDO wave functions (1975) (34)
The effect of the amino-acid side chains on the energy profiles for ion transport in the gramicidin A channel. (1985) (32)
Theoretical study of the packing of α-helices by energy minimization: effect of the length of the helices on the packing energy and on the optimal configuration of a pair (1986) (32)
Thoeretical study of the packing of α-helices of poly(l-alanine) into transmembrane bundles. Possible significance for ion-transfer (1986) (32)
On the electronic structure of the hydrogen-bond: Formamide and its dimers (1968) (31)
Contribution of Theoretical Chemistry to the Study of Ion Transport Through Membranes (1991) (31)
Model studies on the active site of carbonic anhydrase: Ligand properties and CO2 binding (1979) (30)
All valence-electrons calculations on purines and pyrimidines (1968) (30)
THE ELECTRONIC STRUCTURE OF PURINES AND PYRIMIDINES * (1969) (30)
Electrostatic molecular potentials in hydrogen-bonded systems (1978) (29)
Submolecular Structure of the Nucleic Acids (1961) (29)
The electrostatic field of B-DNA (1982) (28)
Non empirical quantum mechanical calculations of the1H,13C,15N and17O magnetic shielding constants and of the spin-spin coupling constants in formamide, hydrated formamide and N-methylformamide (1981) (28)
Anab initio SCF molecular orbital study of acetylcholine (1973) (28)
On the origin of the reverse order of intrinsic affinities towards H+ and Li+ in the series NH3 to N(CH3)3 (1975) (27)
The gramicidin A channel (1986) (27)
The electrostatic molecular potential of yeast tRNAPhe. (I). The potential due to the phosphate backbone. (1980) (27)
The electrostatic molecular potential of tRNAPhe. IV. The potentials and steric accessibilities of sites associated with the bases. (1980) (27)
The Electrostatic Molecular Potential of the Nucleic Acids (1981) (27)
The molecular electrostatic potentials of the complementary base pairs of DNA (1978) (26)
CARBONIC ANHYDRASE: THEORETICAL STUDIES OF DIFFERENT HYPOTHESES (1981) (26)
Experimental and quantum-chemical studies of the dipole moments of quinoline and indole (1970) (26)
Do helices in membranes prefer to form bundles or stay dispersed in the lipid phase? (1991) (25)
The effect of cation binding on the rotation barrier of the peptide bond (1974) (25)
Acetylcholine, gauche or trans? Standard ab initio self-consistent field investigation (1973) (25)
On the binding of water to the ammonium ion: The interplay of an improved basis set. Dispersion and zero-point energy (1985) (25)
The gramicidin A channel: energetics and structural characteristics of the progression of a sodium ion in the presence of water. (1986) (25)
Cation–ligand interactions: Reproduction of extended basis set Ab initio SCF computations by the SIBFA 2 additive procedure (1985) (25)
THEORETICAL STUDY OF BINDING AND PROTON-LABILIZING PROPERTIES OF ZINC(2+) ION (1977) (25)
On a paper by Nagata, Fukui, Yonezawa and Tagashira: electronic structure and carcinogenic activity of aromatic molecules. (1956) (24)
Molecular potential, cation binding, and hydration properties of the carboxylate anion. Ab initio studies with an extended polarized basis set (1981) (24)
Affinities of Ammonia and Methylamine for H+, Li+, K+ and CH3+ An Ab Initio SCF Study with Large Basis Sets (1980) (24)
Nuclear magnetic resonance spectroscopy applied to Li+ complexation by small ligands: An ab initio and experimental study of 7Li chemical shifts (1980) (23)
Calculation of the molecular electrostatic potential from a multipole expansion based on localized orbitals (1982) (23)
On the use of pseudopotentials in molecular calculations (1978) (22)
A theoretical study of the selective alkali and alkaline‐earth cation binding properties of valinomycin (1981) (22)
The molecular electrostatic potential of the B-DNA helix (1979) (22)
Model Studies On The Binding Of Metal Cations To Macrocyclic Ligands. The Interaction of Li+ with Carbonyl Groups (1974) (21)
Interactions in a phosphate—water—cation system (1977) (21)
The ionization potentials of the π- and lone-pair electrons of biochemical purines and pyrimidines☆ (1964) (21)
Cation binding to biomolecules. the screening of the electrostatic potential of the phosphate group by mono- and divalent cations. (1976) (21)
On the electrostatic properties of papain in relation to its enzymatic activity (1983) (21)
The calculation of molecular electrostatic potential from a multipole expansion based on localized orbitals and developed at their centroids: Accuracy and applicability for macromolecular computations (1982) (20)
The Solvent Effect: Recent Developments (1976) (20)
Configuration mixing involving σ and π orbitals (1970) (20)
The interaction of alkali metal cations with oxygen-containing ligands (1975) (20)
Theoretical study of the packing of alpha-helices into possible transmembrane bundles. Sequences including alanines, leucines and serines. (1987) (20)
Energy profiles in the acetylcholine receptor (AChR) channel The MII‐helix model and the role of the remaining helices (1989) (19)
Electronic Structure of Energy-Rich Phosphates (1960) (19)
An ab-initio SCF study of the binding of Li+ to bases (1977) (18)
Theoretical study of the interaction of nonactin with Na+, K+, and NH (1982) (17)
The gramicidin A channel: theoretical energy profile computed for single occupancy by a divalent cation, Ca2+ (1985) (17)
The electrostatic potential and steric accessibility of reactive sites within Z-DNA. (1980) (17)
Interaction of the Tetramethylammonium Ion with the Cycles of Aromatic Amino Acids beyond the SCF Ab Initio Level (1998) (17)
How can the aromatic side-chains modulate the conductance of the gramicidin channel? A new approach using non-coded amino acids. (2009) (17)
The molecular electrostatic potential of the B-DNA helix (1979) (17)
Ab initio study of the stepwise hydration of NO (1984) (17)
Nucleophilicity of DNA. Relation to Chemical Carcinogenesis. (1980) (16)
On the affinities of ammonia and water for Li+, Na+ and K+ (1980) (16)
The role of the σ‐framework in the properties of the biological purines and pyrimidines: dipole moments and tautomeric equilibria (1964) (16)
Ab initio molecular-orbital study of the binding of ZnII with SH2 and SH− (1978) (16)
The electrostatic molecular potential of yeast tRNAPhe. III. The molecular potential and the steric acessibility associated with the phosphate groups (1980) (15)
Ab initio studies of hydrogen bonding between peptide units. IV. The mutual orientations of the peptide planes (1972) (15)
ELEMENTS OF A GENERAL THEORY OF ENZYMATIC HYDROLYSIS. (1959) (15)
Conformation and pairing properties of the N-terminal fragments of trichorzianine and alamethicin: a theoretical study. (1988) (15)
Electron Transfer and Carcinogenesis (1962) (15)
Linear Gramicidins : Influence of the Nature of the Aromatic Side Chains of the Channel Conductance (1988) (14)
Components of the interaction energy of benzene with Na+ and methylammonium cations (2001) (14)
On the Specific Reactivity of Chlorins Toward an Electrophilic Attack on the Methene Bridges (1963) (14)
On the relative acidity and basicity of the amino groups of the nucleic acid bases (1978) (14)
Cation binding to biomolecules (1979) (14)
Electron-Donor or Electron-Acceptor Properties and Carcinogenic Activity of Organic Molecules (1963) (13)
Theoretical study of potential ion-channels formed by a bundle of alpha-helices: effect of the presence of polar residues along the channel inner wall. (1987) (13)
Aspects of the electron distribution in adenine, thymine and cytosine as given by probability density curves from nonempirical calculations (1970) (13)
The effect of point mutations on energy profiles in a model of the nicotinic acetylcholine receptor (AChR) channel. (1991) (13)
Molecular electrostatic potential versus field. Significance for DNA and its constituents (1983) (13)
Experimental and theoretical study of gramicidin P, an analog of gramicidin A with a methylamine C‐terminal (1987) (13)
An ab initio study of the binding of N2 to Na+ and K+ (1984) (12)
The oxido-reductive properties of organic dyes of biological importance. (1959) (12)
Quantum biochemistry at the all- or quasi-all-electrons level (1972) (12)
Molecular Electrostatic Potentials A Tool for Studying Biochemical Protonation Reactions (1974) (12)
Intermolecular interactions: Reproduction of the results of ab initio supermolecule computations by an additive procedure (2009) (11)
Theoritical Study of Potential Ion-Chanels Formed by Bundles of α-Helices. Partial Modelling of the Acetylcholine Receptor Channel (1988) (11)
Quantum-mechanical exploration of the properties of the sugar rings (1978) (11)
On the sites and mechanisms of alkylation in the nucleic acids (1979) (10)
Molecular aspects of channel formation and ion transport through membranes (1988) (10)
Anion-ligand interactions: ab initio study of the binding of H2O, CO2 and SO2 to the nitrite ion (1981) (10)
ON THE MECHANISM OF ULTRAVIOLET-INDUCED MUTATIONS. (1963) (10)
The intrinsic molecular potential of glyceryl monooleate layers and its effect on the conformation and orientation of an inserted molecule: example of gramicidin A. (1990) (10)
The electrostatic field of the component units of DNA and its relationship to hydration. (1983) (10)
Configuration mixing involving σ and π orbitals (1971) (9)
THE THEORY OF CHEMICAL CARCINOGENESIS AND THE PROBLEM OF HYDROCARBON-PROTEIN INTERACTIONS. (1964) (9)
The cis-trans isomerization of conjugated polyenes and the occurrence of a hindered cis-isomer of retinene in the rhodopsin system. (1961) (8)
Interactions and packing of lipids around a helical hydrophobic polypeptide. The system gramicidin A/glycerylmonooleate (1991) (8)
Quantum mechanical studies of environmental effects on biomolecules (1977) (8)
Quantum-mechanical studies of environmental effects on biomolecules. I. Hydration of formamide. (2009) (8)
Electronic structure and carcinogenic activity of aromatic molecules: new developments. (1954) (8)
On the 6-aminonicotinamide antagonism of DPN-dependent enzymatic systems. (1959) (7)
Energy profile of Cs+ in gramicidin A in the presence of water. Problem of the ion selectivity of the channel. (1988) (7)
The nuclear magnetic shielding constants of formamide: the contribution of the non-tightly bound water molecules of the (1985) (7)
An ab initio study of the hydration and ammoniation of ammonium ions (2009) (7)
Electrostatic effect of the macromolecular structure on the biochemical reactivity of the nucleic acids. Significance for chemical carcinogenesis (2009) (7)
Zero‐field splitting parameters in heterocyclic molecules II. Calculations using SCF, SCF CM and UHF wave functions (1969) (7)
A theoretical study of the effect of structural variations on the biochemical reactivity of yeast tRNAPhe and yeast tRNAAsp. (1985) (7)
Molecular electrostatic potentials of hydrogen-bonded systems: The oligomers of formamide (1980) (6)
Theoretical Studies of the Polymorphism and Microheterogeneity of DNA (1983) (6)
ACETYLCHOLINE, GAUCHE OR TRANS, A STANDARD AB INITIO SELF‐CONSISTENT FIELD INVESTIGATION (1973) (6)
The electrostatic molecular potential of tRNAPhe. V. The influence of counterion binding on the potential and the steric accessibility (1981) (6)
Electronic Delocalization and Biochemical Evolution (1963) (6)
Theoretical study of the binding of the chloride anion to water and alcohols (1997) (6)
Zero-field splitting parameters in heterocyclic molecules III. Explicit configuration mixing and double pertubation treatment including doubly excited configurations (1970) (6)
The use of improved atomic orbitals in the evaluation of zero-field splitting integrals (1967) (5)
The Supermolecule Approach to the Solvation Problem (1980) (5)
Determination of a set of parameters for the molecular modelling of phosphorothioate DNA (1999) (5)
THE INFLUENCE OF HETEROATOMS AND SUBTITUENTS ON THE TAUTOMERIC EQUILIBRIA IN BIOCHEMICAL PURINES AND PYRIMIDINES. I. AZAPURINES AND AZAPYRIMIDINES. (1964) (5)
The Gramicidin a Channel: Left Versus Right-Handed Helix (1988) (5)
Quantum mechanical studies of environmental effects on biomolecules (1979) (5)
Antiaromaticity of the cyclobutadiene ring (1971) (4)
Cation π interaction between acetylcholine and the benzene ring (2000) (4)
Ab initio calculations of the magnetic shielding tensors of the 1H and 13C nuclei of the formate ion (1981) (4)
Excitation transfer and carcinogenesis. (1963) (3)
The electronic structure of some free radicals (1947) (3)
Charge Transfer Complexes in Biochemistry (1966) (3)
Bound Water in Biological Systems: A Quantum-Mechanical Investigation (1977) (3)
Theoretical studies on the formation and properties of bundles of alpha-helices and their aptitude to form ion-channels. (1988) (3)
The energy profile calculated for Na+ in the presence of water with inclusion of the flexibility of the ethanolamine tail (1986) (3)
Theoretical Studies on Models of the Active Site of Carbonic Anhydrase (1979) (3)
Cation‐ligand interactions: Ab Initio SCF studies of the binding properties of alkali, alkaline‐earth, and ammonium ions (2009) (3)
On the possibilities of correlating the redox potential of reversible systems to the molecular orbitals involved in the electron transfer (1962) (3)
Molecular electrostatic potential of the b-dna helix. VII. effect of screening by monovalent cations (2009) (2)
Quantum-mechanical studies of environmental effects on biomolecules. III. Ab initio model studies of the hydration of peptides and proteins (2009) (2)
Computed energy profiles for ion transport in the gramicidin A channel (1985) (2)
Binding sites of acetylcholine in the aromatic gorge leading to the active site of acetylcholinesterase (1995) (2)
Photodissociation of Methyl Iodide Clusters (1987) (2)
Ions and ionophores (1983) (2)
AN AB INITIO SCF MOLECULAR ORBITAL STUDY OF ACETYLCHOLINE (1974) (2)
Electronic structure and antitumour activity of imidazo [4,5-d]-pyridazines☆ (1960) (2)
The dependence of the electrostatic properties of model phospholipid monolayers on their molecular organization (2009) (1)
CATION BINDING TO BIOMOLECULES. VI. SCF AB INITIO (PSEUDOPOTENTIAL) COMPUTATIONS ON THE INTERACTION OF ZINC(2+) WITH THE PURINE AND PYRIMIDINE BASES OF THE NUCLEIC ACIDS (1979) (1)
[Energetic characteristics of carcinogenic hydrocarbons]. (1950) (1)
Quantum-Mechanical Studies on Cation Binding to Constituents of Nucleic Acids and Phospholipids (1977) (1)
[INFLUENCE OF THE HYDROGEN BOND ON THE DIPOLAR MOMENT OF PURINE-PYRIMIDINE PAIRS OF NUCLEIC ACIDS]. (1964) (1)
[DIPOLAR MOMENTS AND MOMENTS OF TRANSITION OF PURINE AND PYRIMIDINE BASES OF BIOLOGICAL INTEREST]. (1963) (1)
Theoretical study of the 2:1 Mg2+ and Ca2+ complexes of ionophore A23187 (2009) (1)
Transport through membranes : carriers, channels, and pumps : proceedings of the Twenty-first Jerusalem Symposium on Quantum Chemistry and Biochemistry, held in Jerusalem, Israel, May 16-19, 1988 (1988) (1)
Cation-Ionophore Interactions: Quantification of the Factors Underlying Selective Complexation by Means of Theoretical Computations (1986) (1)
Electrostatic Molecular Potential Versus Field in Nucleic Acids and Their Constituents (1983) (1)
A comparative study of different all-valence-electrons calculations on biological purines and pyrimidines (2009) (1)
Membrane proteins : structures, interactions and models : proceedings of the twenty-fifth Jerusalem Symposium on Quantum Chemistry and Biochemistry held in Jerusalem, Israel, May 18-21, 1992 (1992) (1)
Theoretical studies of the conformations and interaction properties of neutral lipid molecules: glycerylmonooleate (1991) (1)
Model Studies on the Conformational Lability and Carbon-Binding Abilities of Antibiotic Cyclic Depsipeptides (1974) (1)
The use of pseudopotentials for the study of cation-ligand and intermolecular interactions (2009) (1)
Steric and electronic factors in the reactivity of yeast tRNAPhe. (1985) (1)
A program for flexible lattice energy minimization (FLATER) and its application to the study of protein–lipid copacking (1991) (1)
Chapter I - Quantum Biochemistry (1967) (1)
Large finite systems : proceedings of the Twentieth Jerusalem Symposium on Quantum Chemistry and Biochemistry held in Jerusalem, Israel, May 11-14, 1987 (1987) (1)
The MCM (Most Complicated Molecule) in Today’s Quantum, Chemistry : tRNAPhe. Molecular Potential Versus Molecular Field (1983) (1)
Computation of energy profiles in the gramicidin A channel. (1986) (1)
On the Complexation of the Methylammonium Ion by Aromatic Side Chains of Proteins (1992) (1)
NON EMPIRICAL QUANTUM MECHANICAL CALCULATIONS OF THE (1)H, (13)C, (15)N, AND (17)O MAGNETIC SHIELDING CONSTANTS AND OF THE SPIN-SPIN COUPLING CONSTANTS IN FORMAMIDE, HYDRATED FORMAMIDE AND N-METHYLFORMAMIDE (1981) (1)
Molecular Orbital ‘Supermolecule’ Approach to the Solvation Problem (1976) (1)
Towards a molecular model of the acetylcholine receptor channel (1991) (0)
[Aspects of the electronic structure of new types of aromatic carcinogenic compounds]. (1963) (0)
[Electronic characteristics of conjugated polyenes of biological interest (carotenoids, vitamins A, retinenes)]. (1960) (0)
Quantum-Mechanical Studies on the Binding Properties of Small Atmosphere Molecules (1986) (0)
An ab initio study of a nucleoside: Uridine (2009) (0)
[The characteristics of the active centers of aromatic hydrocarbons in relation to their carcinogenic power]. (1953) (0)
On the calculation of the distribution of the electronic cloud in aromatic molecules. (1945) (0)
Computer-aided exploration of ion channels in membranes: modeling the acetylcholine receptor (AChR) channel (1991) (0)
The Phosphate Group in Quantum Biochemistry (1976) (0)
[Tautomerism of purine and pyrimidine bases and the theory of mutations]. (1962) (0)
Quantum mechanical studies of environmental effects on biomolecules (1977) (0)
[Electron structure & function of respiratory coenzymes]. (1959) (0)
[On the overlapping factor in the combination of purines and pyrimidines in solution]. (1965) (0)
On the possibilities of semiempirical calculations of zero‐field splitting parameters (2009) (0)
SCF ab initio study of the “through‐water” versus “direct” binding of the Na+ and Mg2+ cations to the phosphate anion (2009) (0)
Model quantum‐chemical studies on the reaction between the candidate proximate carcinogen benzo(a)pyrene‐7,8‐dihydrodiol‐9,10‐epoxide and guanine (2009) (0)
On an electronic theory of the carcinogenic action of condensed aromatic hydrocarbons. (1945) (0)
[On the excited states of purines and pyrimidines]. (1966) (0)
Electronic structure of energyrich phosphates. (1960) (0)
[On the interaction of 2 conjugated systems across a hydrogen bond]. (1963) (0)
Complexes of Neutral Molecules onto Negative Ions (1981) (0)
THE IONIZATION POTENTIALS OF THE PI- AND LONE-PAIR ELECTRONS OF BIOCHEMICAL PURINES AND PYRIMIDINES. (1964) (0)
Molecular electrostatic potential of the B-DNA helix. V. Poly(dG·dC) and poly(dA·dT) (2009) (0)
A theoretical study of the 2: 1Mg2+ and Ca2+ complexes of N,N,N',N'-tetrapropyl3,6 dioxaoctane diamide (1986) (0)
Theoretical Analysis of Factors Responsible for Specificity in Ionophore-Cation Interactions (1984) (0)
Modelling the inner wall of the AChR channel (1990) (0)
[Reactions of protonation and alkylation of nucleic acid bases]. (1977) (0)
Configuration mixing involving σ and π orbitals (1970) (0)
Book Review:Intermolecular Interactions and Biomolecular Organization. A. J. Hopfinger (1978) (0)
[Factors conditioning appearance of carcinogenic activity in aromatic hydrocarbons]. (1953) (0)
Nucleophilic Affinity of Conjugated Heterocycles in Protonation, Alkylation and Cation Binding (1979) (0)
AB INITIO STUDY OF THE EFFECT OF THE 3D ORBITALS OF PHOSPHORUS ON THE PROPERTIES OF THE PHOSPHATE GROUP (1976) (0)
[Electronic structure of fundamental intermediates in synthesis de novo and metabolic degradation of nucleic acids]. (1958) (0)
[On the carcinogenic activity of hydroaromatic hydrocarbons]. (1960) (0)
Search for General Features in Cation-Ligand Binding. Ab Initio SCF Studies of the Interaction of Alkali and Alkaline Earth Ions with Water (1977) (0)
Electrostatic molecular potentials in hydrogen-bonded systems (1978) (0)
Ad '405 259 Defense Documentation Center for Scientific and Technical Information (0)
Quantum biochemistry and, specific interactions: by Zeno Simon, published by Abacus Press, U.K., 1976. £11.95 (approx. $20.-) (251 pages) (1977) (0)
Ab initio studies on the binding of Na+ and K+ to the fundamental components of depsipeptides (2009) (0)
Modelling of biomolecular structures and mechanisms : proceedings of the Twenty-seventh Jerusalem Symposium on Quantum Chemistry and Biochemistry, held in Jerusalem, Israel, May 23-26, 1994 (1995) (0)
Large Finite Systems Proceedings of the Twentieth Jerusalem Symposium on Quantum Chemistry and Biochemistry Held in D. Reidel Publishing Company a Member Ofthe Kluwer ^ · " Academic Publishers Group (0)

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