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- [1] ABINITIO AND CNDO-2 MOLECULAR-ORBITAL CALCULATIONS OF DEWAR AND VALENE STRUCTURES OF PYRROLE AND FURANJOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1981, 2 (3-4): : 303 - 309LATAJKA, ZRATAJCZAK, HORVILLETHOMAS, WJRATAJCZAK, E
- [2] ABINITIO CALCULATIONS OF H-2-H-2 POTENTIAL SURFACES NEAR THE VANDERWAALS MINIMUMCHEMICAL PHYSICS, 1987, 116 (01) : 11 - 19LAVENDY, HROBBE, JMCHAMBAUD, GLEVY, B
- [3] COMPARISON OF POTENTIAL SURFACES OF NONRIGID MOLECULE OF LIBH4 CALCULATED ABINITIO AND IN SEMI-EMPIRICAL CNDO-2 SCHEMEJOURNAL OF STRUCTURAL CHEMISTRY, 1978, 19 (02) : 301 - 305BOLDYREV, AICHARKIN, OPAVDEEV, VI
- [4] MNDO AND MNDO-H CALCULATIONS ON HYDROGEN-BONDS - A COMPARISON WITH ABINITIO AND CNDO-2 METHODSJOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1985, 23 (3-4): : 343 - 350KOLLER, JHARB, VHODOSCEK, MHADZI, D
- [5] ABINITIO CALCULATIONS OF POTENTIAL SURFACES AND GEOMETRY OF NONRIGID MOLECULES .2. COMPLEX MOLECULE LIBEH3JOURNAL OF STRUCTURAL CHEMISTRY, 1977, 18 (05) : 623 - 631BOLDYREV, AICHARKIN, OP
- [6] A COMPARATIVE-STUDY OF THE HYDRATION OF ALIPHATIC AMINO-ACIDS BY CNDO/2 AND ABINITIO MOLECULAR-ORBITAL CALCULATIONSJOURNAL OF THE SCIENCE SOCIETY OF THAILAND, 1985, 11 (03): : 113 - 119DOUNGDEE, PBKOKPOL, SURODE, BM
- [8] CHARGE DISTRIBUTIONS AND CHEMICAL EFFECTS .3. COMPARISON WITH PCILO AND CNDO/2 CALCULATIONSCANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 1973, 51 (07): : 991 - 996FLISZAR, SSYGUSCH, J
- [9] RELATIONSHIPS BETWEEN THE ACTIVITY OF SOME H2-RECEPTOR AGONISTS OF HISTAMINE AND THEIR ABINITIO MOLECULAR ELECTROSTATIC POTENTIAL (MEP) AND ELECTRON-DENSITY COMPARISON COEFFICIENTSEUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 1988, 23 (01) : 7 - 10LUQUE, FJSANZ, FILLAS, FPOUPLANA, RSMEYERS, YG