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DESIGN, SYNTHESIS, AND TESTING OF ANTISICKLING AGENTS. II: PROLINE DERIVATIVES DESIGNED FOR THE DONOR SITEABRAHAM DJ; MOKOTOFF M; SHEH L et al.1983; JOURNAL OF MEDICINAL CHEMISTRY; ISSN 0022-2623; USA; DA. 1983; VOL. 26; NO 4; PP. 549-554; BIBL. 42 REF.Article

AB INITIO REFINEMENT OF AN ORBITAL-CENTRED FORCE FIELD FOR BIOMOLECULES: ORBITAL LOCALISATION AND PARAMETERISATION OF THE C-O-P(O2)-O-C FRAGMENT OF NUCLEOTIDESPLATT E; ROBSON B; HILLIER IH et al.1981; J. THEOR. BIOL.; ISSN 0022-5193; GBR; DA. 1981; VOL. 88; NO 2; PP. 333-353; BIBL. 22 REF.Article

REGIOSELECTIVITE DE LA REDUCTION DE TROPONES DE LA QUINOXALINETURCK A; BOUTTE R; LOUPY A et al.1982; TETRAHEDRON; ISSN 0040-4020; GBR; DA. 1982; VOL. 38; NO 20; PP. 3043-3050; ABS. ENG; BIBL. 52 REF.Article

CALCUL AB INITIO DE LA SURFACE DE POTENTIEL APPROCHEE DU CHEMIN REACTIONNEL LE PLUS COURT POUR BH+H2->BH3BOZHENKO KV; BOLDYREV AI; CHARKIN OP et al.1978; ZH. NEORG. KHIM.; SUN; DA. 1978; VOL. 23; NO 11; PP. 2883-2889; BIBL. 16 REF.Article

PENTALENEJEAN Y.1980; NOUV. J. CHIM.; FRA; DA. 1980; VOL. 4; NO 1; PP. 11-15; BIBL. 24 REF.Article

REACTION MECHANISM OF HYDROBORATION. AB INITIO MO STUDY ON THE C2H4+BH3 REACTIONNAGASE S; RAY NK; MOROKUMA K et al.1980; J. AMER. CHEM. SOC.; USA; DA. 1980; VOL. 102; NO 13; PP. 4536-4537; BIBL. 16 REF.Article

A STATISTICAL ANALYSIS OF THE THEORETICAL RESULTS OBTAINED FOR CONCERTED 1,3-DIPOLAR CYCLOADDITIONSANA M; LEROY G; DIVE G et al.1982; J. MOL. STRUCT.; ISSN 0022-2860; NLD; DA. 1982; VOL. 89; NO 1-2; PP. 147-163; BIBL. 32 REF.Article

THE IMPORTANCE OF HYPERCONJUGATION IN NUCLEOPHILIC VINYLIC SUBSTITUTIONAPELOIG Y; RAPPOPORT Z.1979; J. AMER. CHEM. SOC.; USA; DA. 1979; VOL. 101; NO 17; PP. 5095-5098; BIBL. 28 REF.Article

EXAMEN PAR LA METHODE DES ORBITALES MOLECULAIRES DES PREFERENCES CONFORMATIONNELLES INTRINSEQUES DU SQUELETTE DES ACIDES NUCLEIQUESBROCH H; VASILESCU D.1979; BIOPOLYMERS; USA; DA. 1979; VOL. 18; NO 4; PP. 909-930; ABS. ENG; BIBL. 52 REF.Article

RECENT DEVELOPMENTS IN THEORETICAL ORGANOMETALLIC CHEMISTRY.MINGOS DMP.1977; ADV. ORGANOMETAL. CHEM.; U.S.A.; DA. 1977; VOL. 15; PP. 1-51; BIBL. 6 P. 1/2Article

AB INITIO MOLECULAR ORBITAL CALCULATIONS ON THE REACTION PATH OF THE KETOCARBENE-KETENE REARRANGEMENT.STRAUSZ OP; GOSAVI RK; GUNNING HE et al.1977; J. CHEM. PHYS.; U.S.A.; DA. 1977; VOL. 67; NO 7; PP. 3057-3061; BIBL. 17 REF.Article

MECHANISM OF HYDROBORATION IN ETHER SOLVENTS. A MODEL AB INITIO STUDYCLARK T; WILHELM D; VON RAGUE SCHLEYER P et al.1983; JOURNAL OF THE CHEMICAL SOCIETY. CHEMICAL COMMUNICATIONS; ISSN 0022-4936; GBR; DA. 1983; NO 11; PP. 606-608; BIBL. 15 REF.Article

AB INITIO STUDIES OF MOLECULAR GEOMETRIES. XXIIV. OPTIMIZED MOLECULAR STRUCTURES AND CONFORMATIONAL ANALYSIS OF NALPHA -ACETYL-N-METHYLALANINAMIDE AND COMPARISON WITH PEPTIDE CRYSTAL DATA AND EMPIRICAL CALCULATIONSSCARSDALE JN; VAN ALSENOY C; KLIMKOWSKI VJ et al.1983; JOURNAL OF THE AMERICAN CHEMICAL SOCIETY; ISSN 0002-7863; USA; DA. 1983; VOL. 105; NO 11; PP. 3438-3445; BIBL. DISSEM.Article

THEORETICAL STUDIES OF THE INDUCTIVE EFFECT. III: A THEORETICAL SCALE OF FIELD PARAMETERSMARRIOTT S; TOPSOM RD.1982; TETRAHEDRON LETT.; ISSN 0040-4039; GBR; DA. 1982; VOL. 23; NO 14; PP. 1485-1488; BIBL. 10 REF.Article

FORCE DECOMPOSITION ANALYSIS ALONG REACTION COORDINATE.JOSHI BD; MOROKUMA K.1977; J. CHEM. PHYS.; U.S.A.; DA. 1977; VOL. 67; NO 11; PP. 4880-4883; BIBL. 14 REF.Article

IN SUPPORT OF ANIONIC HYPERCONJUGATION. THE VERSATILE METHYL GROUP.DEFREES DJ; BERTMESS JE; KIM JK et al.1977; J. AMER. CHEM. SOC.; U.S.A.; DA. 1977; VOL. 99; NO 19; PP. 6451-6452; BIBL. 19 REF.Article

AN AB INITIO STUDY OF THE REACTION OF AMMONIUM ION WITH HYDRIDE ION AND LITHIUM HYDRIDE.MOROSI G; SIMONETTA M.1977; CHEM. PHYS. LETTERS; NETHERL.; DA. 1977; VOL. 47; NO 2; PP. 396-398; BIBL. 10 REF.Article

PREDICTION OF A NEW PHASE IN SOLID N2 AT HIGH PRESSUREKOBASHI K; HELMY AA; ETTERS RD et al.1982; PHYSICAL REVIEW. B: CONDENSED MATTER; ISSN 0163-1829; USA; DA. 1982; VOL. 26; NO 10; PP. 5996-5999; BIBL. 17 REF.Article

SUBSTITUENT ELECTRONEGATIVITIESREYNOLDS WF; TAFT RW; MARRIOTT S et al.1982; TETRAHEDRON LETT.; ISSN 0040-4039; GBR; DA. 1982; VOL. 23; NO 10; PP. 1055-1058; BIBL. 13 REF.Article

AZOXY COMPOUNDS AND OXADIAZIRIDINES. AN AB INITIO STUDY OF THE RING CLOSURE REACTIONS AND OF THE CIS-TRANS ISOMERIZATIONS.CIMIRAGLIA R; PERSICO M; TOMASI J et al.1977; J. PHYS. CHEM.; U.S.A.; DA. 1977; VOL. 61; NO 19; PP. 1876-1882; BIBL. 37 REF.Article

POLARIZATION MODEL FOR NH3-H-H2O PROTON TRANSFER REACTIONDAVID CW.1983; JOURNAL OF CHEMICAL PHYSICS; ISSN 0021-9606; USA; DA. 1983; VOL. 78; NO 8; PP. 5268-5269; BIBL. 5 REF.Article

AB INITIO MO STUDY ON BASE STACKING: ADENINE-ADENINE INTERACTION IN SINGLE-STRANDED POLYADENYLIC ACID (POLY A)AIDA M; NAGATA C.1982; CHEM. PHYS. LETT.; ISSN 0009-2614; NLD; DA. 1982; VOL. 86; NO 1; PP. 44-46; BIBL. 23 REF.Article

AB INITIO CALCULATIONS OF THE ELECTRONIC PROPERTIES OF POLYETHYLENEWEIDMAN RS; BEDFORD KL; KUNZ AB et al.1981; SOLID STATE COMMUN.; ISSN 0038-1098; USA; DA. 1981; VOL. 39; NO 8; PP. 917-919; BIBL. 11 REF.Article

ETAT DE TRANSITION ET THEOREME DU VIRIEL: APPLICATION A L'EVALUATION DES LONGUEURS DE LIAISON EN COURS DE FORMATION OU DE RUPTURE DANS LES REACTIONS ELECTROCYCLIQUESBLAISE P; HENRI ROUSSEAU O.1979; NOUV. J. CHIM.; FRA; DA. 1979; VOL. 3; NO 6; PP. 369-377; BIBL. 35 REF.Article

ETUDE THEORIQUE DE L'ACIDITE DES HYDROGENES DU GROUPEMENT METHYLE EN POSITION ALPHA D'UNE FONCTION CARBONYLE. APPLICATION A LA MOLECULE D'ACETALDEHYDEABOU RACHID H; LARRIEU C; CHAILLET M et al.1983; TETRAHEDRON; ISSN 0040-4020; GBR; DA. 1983; VOL. 39; NO 8; PP. 1307-1312; ABS. ENG; BIBL. 16 REF.Article

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