AN EFFECT OF POTENTIAL SHALLOWING AND THE DETERMINATION OF BARRIERS TO INTERNAL ROTATION (IN ELECTRON DIFFRACTION)SCHARFENBERG P.1982; J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1982; VOL. 77; NO 9; PP. 4791-4793; BIBL. 9 REF.Article

SOME REMARKS ON A TRANSFORMATION SATISFYING THE CONSTRAINT OF MAXIMUM SIMILARITY OF CONCERNED FUNCTIONS.SCHARFENBERG P.1978; INTERNATION. J. QUANTUM CHEM.; USA; DA. 1978; VOL. 13; NO 1; PP. 155-158; BIBL. 7 REF.Article

AN APPLICATION OF THE CANONICAL ORTHONORMALIZATION TO A UNION OF COMPLTETE ATOMIC ORBITAL SETSSCHARFENBERG P.1981; CHEM. PHYS. LETT.; ISSN 0009-2614; NLD; DA. 1981; VOL. 78; NO 1; PP. 184-186; BIBL. 6 REF.Article

BERECHNUNG DER INVERSION UND INNEREN ROTATION DER ANILIN-MOLEKEL FUER STANDARD- UND OPTIMIERTE (CNDO/2)-GEOMETRIEMODELLE = CALCUL DE L'INVERSION ET LA ROTATION INTERNE DE L'ANILINE COMME MODELE GEOMETRIQUE STANDARD ET OPTIMISE (CNDO/2)SCHARFENBERG P.1979; Z. CHEM.; DDR; DA. 1979; VOL. 19; NO 5; PP. 198-200; BIBL. 16 REF.Article

EINE VARIANTE DES CNDO-VERFAHRENS UNTER EINBEZIEHUNG VON D-FUNKTIONEN = UNE VARIANTE DU PROCEDE CNDO AVEC INTRODUCTION DE FONCTIONS DSCHARFENBERG P.1978; THEOR. CHIM. ACTA; DEU; DA. 1978; VOL. 49; NO 2; PP. 115-122; ABS. ENG; BIBL. 31 REF.Article

ANALYSIS OF CRITICAL POINTS ON THE POTENTIAL ENERGY SURFACESCHARFENBERG P.1980; THEOR. CHIM. ACTA; ISSN 0040-5744; DEU; DA. 1980; VOL. 58; NO 1; PP. 73-79; BIBL. 14 REF.Article

A NEW ALGORITHM FOR THE SYMMETRIC (LOEWDIN) ORTHONORMALIZATION.SCHARFENBERG P.1977; INTERNATION. J. QUANTUM CHEM.; U.S.A.; DA. 1977; VOL. 12; NO 5; PP. 827-839; ABS. FR. ALLEM.; BIBL. 15 REF.Article

AN IMPROVED METHOD FOR THE EVALUATION OF TRANSITION STATESSCHARFENBERG P.1982; J. COMPUT. CHEM.; ISSN 0192-8651; USA; DA. 1982; VOL. 3; NO 3; PP. 277-282; BIBL. 28 REF.Article

THEORETICAL ANALYSIS OF CONSTRAINED MINIMUM ENERGY PATHSSCHARFENBERG P.1981; CHEM. PHYS. LETT.; ISSN 0009-2614; NLD; DA. 1981; VOL. 79; NO 1; PP. 115-117; BIBL. 9 REF.Article

CNDO/2 FOR IODINE-CONTAINING MOLECULESSCHARFENBERG P.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 65; NO 2; PP. 304-309; BIBL. 28 REF.Article

INVARIANCE CRITERIA AND SYMMETRY CONSERVATION RULES FOR GEOMETRY OPTIMIZATIONSSCHARFENBERG P.1979; THEOR. CHIM. ACTA; DEU; DA. 1979; VOL. 53; NO 3; PP. 279-292; BIBL. 24 REF.Article

CNDO/2-MOLEKUELGEOMETRIEBERECHNUNGEN UNTER EINBEZIEHUNG VON D-ORBITALEN (CL-, BR-, I- UND SCHWEFELVERBINDUNGEN ALS BEISPIELE). = CALCULS CNDO/2 DE LA GEOMETRIE MOLECULAIRE EN TENANT COMPTE DES ORBITALES D (EXEMPLES DE COMPOSES DE CL, BR, I ET S)SCHARFENBERG P.1977; Z. CHEM.; DTSCH.; DA. 1977; VOL. 17; NO 10; PP. 388-389; BIBL. 9 REF.Article

An improved CNDO/2 standard parametrization for bromine containing moleculesSCHARFENBERG, P.Theoretica chimica acta. 1985, Vol 67, Num 3, pp 235-243, issn 0040-5744Article

BIOLOGICAL RESPONSE AS A FUNCTION OF CONFORMATION, CHIRALITY, AND ELECTRONIC CHARACTERISTICS: A CATECHOLAMINE STUDYSCHARFENBERG P; SAUER J.1980; INT. J. QUANTUM CHEM.; ISSN 0020-7608; USA; DA. 1980; VOL. 18; NO 5; PP. 1309-1337; BIBL. 75 REF.Article

NOTE ON THE INDO GEOMETRY OPTIMIZATION OF BIPHENYL.SCHARFENBERG P; JUNG C.1978; CHEM. PHYS. LETTERS; NLD; DA. 1978; VOL. 57; NO 1; PP. 131-133; BIBL. 15 REF.Article

CONFORMATIONAL AND STRUCTURE OF ETHYLBENZENE IN THE VAPOUR PHASESCHARFENBERG P; ROZSONDAI B; HARGITTAI I et al.1980; Z. NATURFORSCH., A; ISSN 0340-4811; DEU; DA. 1980; VOL. 35; NO 4; PP. 431-436; BIBL. 38 REF.Article

HYDROPHOBICITY AND HYDROPHOBIC INTERACTIONS. II: DIFFERENTIATION OF SURFACE AREA EFFECTS ON SEVERAL THERMODYNAMIC TRANSFER DATA OF HYDROPHOBIC SOLUTESKUEHNE R; BOCEK K; SCHARFENBERG P et al.1981; EUROP. J. MEDICIN. CHEM.; FRA; DA. 1981; VOL. 16; NO 1; PP. 7-12; ABS. FRE/GER; BIBL. 39 REF.Article

On the structural differences of conformers (a study of 1,2-disubstituted ethanes and ethenes)SCHARFENBERG, P; HARGITTAI, I.Journal of molecular structure. 1984, Vol 112, Num 1-2, pp 65-70, issn 0022-2860Article

Crystal and molecular structures of modified progestagens (IV): 17α-azidomethyl-17β-hydroxy-estra-4.9-dien-3-one, C₁₉H₂₅N₃O₂RECK, G; HÜBNER, M; BANNIER, G et al.Crystal research and technology (1979). 1986, Vol 21, Num 9, pp 1191-1197, issn 0232-1300Article

7-Substituted-4-hydroxyquinoline-3-carboxylic acids as inhibitors of dehydrogenase enzymes and of the respiration of Ehrlich ascites tumor cells: multivariate analysis and quantitative structure-activity relationship for polar substituentsDOVE, S; COATS, E; SCHARFENBERG, P et al.Journal of medicinal chemistry (Print). 1985, Vol 28, Num 4, pp 447-451, issn 0022-2623Article

Molecular geometry and tautomerism of 2-carboxymethylamido-3(4H)-quinoxalonePFEIFFER, D; SCHARFENBERG, P; RECK, G et al.Crystal research and technology (1979). 1987, Vol 22, Num 3, pp 381-388, issn 0232-1300Article

The molecular structure of phenylmethylsulfoneBRUNVOLL, J; EXNER, O; HARGITTAI, I et al.Journal of molecular structure. 1984, Vol 117, Num 3-4, pp 317-322, issn 0022-2860Article