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ETUDE THEORIQUE DE LA NUCLEATION HETEROGENE PAR LA METHODE DES ORBITALES MOLECULAIRES: CALCUL DE L'ENERGIE ELECTRONIQUE DES NOYAUXJULG A; BOURG M.1973; SURF. SCI.; NETHERL.; DA. 1973; VOL. 34; NO 3; PP. 705-716; ABS. ANGL.; BIBL. 22 REF.Serial Issue

MOLECULAR ORBITAL CALCULATION FOR BARBITURATESLAPRADE B; PETERSEN H JR; TURCOTTE JG et al.1976; CANAD. J. PHARM. SCI.; CANADA; DA. 1976; VOL. 11; NO 2; PP. 54-57; ABS. FR.; BIBL. 26 REF.Article

A NEW DEVELOPMENT OF THE CONSERVATION OF MOLECULAR ORBITAL SYMMETRY. WITH A REVIEW OF THE THEORIES OF ITS THREE CURRENT SCHOOLSTANG AUCHIN.1975; SCI. SINICA; CHINE; DA. 1975; VOL. 17; NO 3; PP. 342-365; BIBL. 6 REF.Article

MOLEKULAR ORBITAL BERECHNUNGEN ZUR STRUKTUR DES MUSCARIN-PHARMAKOPHORS = CALCULS PAR ORBITALES MOLECULAIRES DE LA STRUCTURE DU PHARMACOPHORE DE LA MUSCARINEHOLTJE HD.1974; ARCH. PHARM.; DTSCH.; DA. 1974; VOL. 307; NO 12; PP. 969-972; BIBL. 10REF.Article

STABLE CONFORMATIONS OF HISTAMINE BY EMPIRICAL METHOD.MAHADEVAPPA KUMBAR.1975; J. THEOR. BIOL.; U.S.A.; DA. 1975; VOL. 53; NO 2; PP. 333-340; BIBL. 20 REF.Article

AN ORBITAL INTERACTION RATIONALE FOR ORGANIC MOLECULES AND REACTIONSFUKUI K.1975; ISRAEL J. CHEM.; ISRAEL; DA. 1975; VOL. 14; PP. 1-10; BIBL. 1 P. 1/2; (INT. CONGR. PURE APPL. CHEM. I.U.P.A.C. 25; JERUSALEM; 1975)Conference Paper

ENERGY BANDS AND ELECTRONIC DELOCALIZATION IN THE SUGAR-PHOSPHATE BACKBONE OF DNASUHAI S.1974; BIOPOLYMERS; U.S.A.; DA. 1974; VOL. 13; NO 9; PP. 1739-1745; BIBL. 12REF.Article

QUANTUM MECHANICAL STUDY OF INTERACTIONS BETWEEN NUCLEIC ACID BASESDANILOV VI; ZHELTOVSKY NV; KUDRITSKAYA ZG et al.1974; STUD. BIOPHYS.; ALLEM.; DA. 1974; VOL. 43; NO 3; PP. 201-216; ABS. RUSSE; BIBL. 1P.1/2Article

QUANTUM-MECHANICAL STUDIES OF ENVIRONMENTAL EFFECTS ON BIOMOLECULES. II. HYDRATION SITES IN PURINES AND PYRIMIDINES = ETUDES PAR LA MECANIQUE QUANTIQUE DES EFFETS DE L'ENVIRONNEMENT SUR LES BIOMOLECULES. II. SITES D'HYDRATATION DANS LES PURINES ET LES PYRIMIDINESPORT GNJ; PULLMAN A.1973; F.E.B.S. LETTERS; NETHERL.; DA. 1973; VOL. 31; NO 1; PP. 70-74; BIBL. 8 REF.Serial Issue

HMO-ANALYSE ZU DEN STRUKTUR-WIRKUNGSBEZIEHUNGEN VON SEDATIVA UND HYPNOTIKA UND DIE ANALYSE POTENTIELLER SEDATIVA IN FORM VON HOMOLOGVERBINDUNGEN = ANALYSE PAR LES ORBITES MOLECULAIRES DE HUECKEL DES RELATIONS ENTRE LA STRUCTURE ET L'ACTIVITE DES SEDATIFS ET DES HYPNOTIQUES ET ANALYSE DES SEDATIFS EVENTUELS SOUS FORME DE COMPOSES HOMOLOGUESSCHULTZ OE; REIMERDES EH.1973; ARZNEIMITTEL-FORSCH.; DTSCH.; DA. 1973; VOL. 23; NO 6; PP. 776-778; ABS. ANGL.; BIBL. 42REF.Serial Issue

MOLECULAR ORBITAL STUDIES OF THE PROTONATION OF THE METHYLANISOLESGREENBERG RS; BURSEY MM; PEDERSEN LG et al.1976; J. AMER. CHEM. SOC.; U.S.A.; DA. 1976; VOL. 98; NO 14; PP. 4061-4064; BIBL. 13 REF.Article

CONFORMATIONAL ANALYSIS OF GLYCOSAMINOGLYCANS. I. CHARGE DISTRIBUTIONS, TORSIONAL POTENTIALS, AND STERIC MAPSROTENZONE R JR; HOPFINGER AJ.1975; CARBOHYD. RES.; NETHERL.; DA. 1975; VOL. 40; NO 2; PP. 323-336; BIBL. 45REFArticle

EFFECT OF AROMATIC MOLECULES ON THE AGGREGATION OF C-PHYCOCYANIN. QUANTUM CHEMICAL CALCULATIONS OF PHYCOCYANOBILIN AND PHYCOERYTHROBILIN.MAHADEVAPPA KUMBAR; MACCALL R.1975; RES. COMMUNIC. CHEM. PATHOL. PHARMACOL.; U.S.A.; DA. 1975; VOL. 11; NO 4; PP. 627-637; BIBL. 1 P. 1/2Article

THE USE OF THE COUNTER-ION IN MOLECULAR ORBITAL CALCULATIONS OF HISTAMINE CONFORMATIONS.ABRAHAM RJ; BIRCH D.1975; MOLEC. PHARMACOL.; U.S.A.; DA. 1975; VOL. 11; NO 5; PP. 663-666; BIBL. 8 REF.Article

EXAMEN DU MODELE GROSSIER DE L'HEME PAR LA METHODE CNDO/2GOLOVANOV IB; SOBOLEV VM; VOL'KENSHTEJN MV et al.1974; DOKL. AKAD. NAUK S.S.S.R.; S.S.S.R.; DA. 1974; VOL. 218; NO 2; PP. 478-480; BIBL. 12REF.Article

ELECTRONIC STRUCTURES OF CEPHALOSPORIN AND PENICILLIN MOIETIESBOYD DB.1972; J. AMER. CHEM. SOC.; U.S.A.; DA. 1972; VOL. 94; NO 18; PP. 6513-6519; BIBL. DISSEM.Serial Issue

ON THE DONOR-ACCEPTOR RELATIONSHIP IN CYCLIC ADDITIONSFUJIMOTO H; INAGAKI S; FUKUI K et al.1976; J. AMER. CHEM. SOC.; U.S.A.; DA. 1976; VOL. 98; NO 9; PP. 2670-2671; BIBL. 12 REF.Article

EXTENSION OF GAUSSIAN 70 TO ANY NUMBER OF ATOMIC ORBITALS. = EXTENSION DE GAUSSIEN 70 A TOUT NOMBRE D'ORBITALES ATOMIQUESCARLSON GL; PEDERSEN LG.1975; J. COMPUT. PHYS.; U.S.A.; DA. 1975; VOL. 17; NO 4; PP. 415-419; BIBL. 4 REF.Article

QUANTUM-MECHANICAL STUDIES ON THE CONFORMATION OF PHOSPHOLIPIDS. THE EFFECT OF WATER ON THE CONFORMATIONAL PROPERTIES OF THE POLAR HEADPULLMAN B; BERTHOD H; GRESH N et al.1975; F.E.B.S. LETTERS; NETHERL.; DA. 1975; VOL. 53; NO 2; PP. 199-204; BIBL. 31REFArticle

CALCULATION OF THE CIRCULAR DICHROISM OF DOUBLE-HELICAL NUCLEIC ACIDS. III. DEPENDENCE OF THE RESULTS ON THE CHOICE OF WAVE FUNCTIONS FOR PURINES AND PYRIMIDINESSTUDDERT DS; DAVIS RC.1974; BIOPOLYMERS; U.S.A.; DA. 1974; VOL. 13; NO 7; PP. 1405-1416; BIBL. 25REF.Article

CONFORMATION OF HISTAMINE DERIVATIVES. II. MOLECULAR ORBITAL CALCULATIONS OF PREFERRED CONFORMATIONS IN RELATION TO DUAL RECEPTOR ACTIVITYGANELLIN CR; PORT GNJ; RICHARDS WG et al.1973; J. MEDICIN. CHEM.; U.S.A.; DA. 1973; VOL. 16; NO 6; PP. 616-620; BIBL. 5REF.Serial Issue

MOLECULAR ORBITAL STUDY OF HAPTEN-ANTIBODY INTERACTIONS = ETUDE PAR LES ORBITALES MOLECULAIRES DES INTERACTIONS HAPTENE-ANTICORPSNEW RRC; RICHARDS WG.1972; NATURE NEW BIOL.; G.B.; DA. 1972; VOL. 237; NO 76; PP. 214; BIBL. 4 REF.Serial Issue

SOME COMPARISONS OF THE RRK AND RRKM THEORIES OF THERMAL UNIMOLECULAR REACTION. ENERGY DISTRIBUTIONS AND THE S PARAMETERSKINNER GB; RABINOVITCH BS.1972; J. PHYS. CHEM.; U.S.A.; DA. 1972; VOL. 76; NO 17; PP. 2418-2424; BIBL. 13 REF.Serial Issue

MOLECULAR ORBITAL STUDIES ON THE CONFORMATION OF PHOSPHOLIPIDS. II. PREFERRED CONFORMATIONS OF HYDROCARBON CHAINS AND MOLECULAR ORGANIZATION IN BIOMEMBRANES.GUPTA SP; GOVIL G; MISHRA RK et al.1975; J. THEOR. BIOL.; U.S.A.; DA. 1975; VOL. 51; NO 1; PP. 13-34; BIBL. 24 REF.Article

QUANTUM MECHANICAL STUDY ON THE CONFORMATIONAL PROPERTIES OF ANTIHISTAMINIC DRUGS = ETUDE MECANIQUE QUANTIQUE DES PROPRIETES DE CONFORMATION DES MEDICAMENTS ANTIHISTAMINIQUESPULLMANN B; COURRIERE P; BERTHOD H et al.1975; MOLEC. PHARMACOL.; U.S.A.; DA. 1975; VOL. 11; NO 3; PP. 268-279; BIBL. 1 P. 1/2Article

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