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Nodes: 16200,
Authors: 18277,
Journals: 1499,
Outer References: 363576,
Words: 15025
Collection span: 1909 - 2005
View: Overview. Sorted by journal name.
Page 78 of 162: 1 11 21 31 41 51 61 [ 71 72 73 74 75 76 77 78 79 80 ] 81 91 | 101
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
|---|---|---|---|---|---|
| 7701 | 7 | 42 | 7891 1978 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 100 (4): 1073-1078 WOOLLEY RG MUST A MOLECULE HAVE A SHAPE | 34 | 111 |
| 7702 | 2 | 49 | 7892 1978 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 100 (4): 1093-1099 LOHR LL THEORETICAL STUDIES OF KINETICS OF PLANAR-TETRAHEDRAL EQUILIBRATION IN NICKEL(II) COMPLEXES .1. REACTION COORDINATES AND POTENTIAL-ENERGY SURFACES | 1 | 16 |
| 7703 | 2 | 49 | 7893 1978 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 100 (15): 4681-4685 HINDE AL; POPPINGER D; RADOM L ABINITIO STUDY OF BENZENE RADICAL-ANION | 1 | 56 |
| 7704 | 8 | 71 | 8181 1979 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 101 (8): 1965-1975 WEIGANG OE AMPLIFIED SECTOR RULE FOR ELECTRIC DIPOLE-ALLOWED TRANSITIONS | 1 | 32 |
| 7705 | 4 | 27 | 8182 1979 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 101 (10): 2531-2534 SEN U STUDY OF ELECTROLYTIC SOLUTION PROCESS USING THE SCALED-PARTICLE THEORY .1. STANDARD FREE-ENERGY OF SOLVATION | 12 | 28 |
| 7706 | 2 | 26 | 8183 1979 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 101 (11): 2793-2803 WONG KY; SCHATZ PN; PIEPHO SB VIBRONIC COUPLING MODEL FOR MIXED-VALENCE COMPOUNDS - COMPARISONS AND PREDICTIONS | 0 | 80 |
| 7707 | 7 | 42 | 8494 1980 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 102 (7): 2181-2188 SEN U STUDY OF ELECTROLYTIC SOLUTION PROCESS USING THE SCALED-PARTICLE THEORY .2. THE STANDARD ENTROPY OF SOLVATION | 7 | 14 |
| 7708 | 2 | 45 | 8803 1981 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 103 (7): 1827-1831 HAMILTON SE; ZERNER B SOLVENT EFFECTS ON THE DEACYLATION OF ACYL-CHYMOTRYPSINS - A CRITICAL COMMENT ON THE CHARGE-RELAY HYPOTHESIS | 0 | 16 |
| 7709 | 2 | 26 | 8804 1981 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 103 (14): 3971-3976 SIMONS J PROPENSITY RULES FOR VIBRATION-INDUCED ELECTRON DETACHMENT OF ANIONS | 0 | 45 |
| 7710 | 3 | 29 | 9115 1982 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 104 (6): 1469-1476 WARSHEL A; BARBOY N ENERGY-STORAGE AND REACTION PATHWAYS IN THE 1ST STEP OF THE VISION PROCESS | 1 | 117 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7711 | 2 | 33 | 9116 1982 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 104 (14): 3789-3792 COX BG; GUMINSKI C; SCHNEIDER H GIBBS FREE-ENERGIES OF TRANSFER OF CRYPTAND (2,2,2) AND AG(2,2,2)CLO4 FROM WATER TO ACETONITRILE WATER MIXTURES | 0 | 33 |
| 7712 | 2 | 77 | 9682 1984 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 106 (8): 2306-2315 STACE AJ PREFERENTIAL SOLVATION OF HYDROGEN-IONS IN MIXED WATER AMINE ION CLUSTERS | 0 | 18 |
| 7713 | 2 | 35 | 9683 1984 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 106 (16): 4341-4348 HOPKINS HP; JAHAGIRDAR DV; MOULIK PS; AUE DH; WEBB HM; et al. BASICITIES OF THE 2-DISUBSTITUTED, 4-DISUBSTITUTED, 2,4-DISUBSTITUTED, AND 2,6-DISUBSTITUTED TERT-BUTYL PYRIDINES IN THE GAS-PHASE AND AQUEOUS PHASE - STERIC EFFECTS IN THE SOLVATION OF TERT-BUTYL-SUBSTITUTED PYRIDINES AND PYRIDINIUM CATIONS | 1 | 45 |
| 7714 | 1 | 72 | 9684 1984 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 106 (20): 6021-6028 VONSZENTPALY L CARCINOGENESIS BY POLYCYCLIC AROMATIC-HYDROCARBONS - A MULTILINEAR REGRESSION ON NEW TYPE PMO INDEXES | 1 | 11 |
| 7715 | 1 | 47 | 9685 1984 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 106 (22): 6726-6735 TROUGHTON EB; MOLTER KE; ARNETT EM COORDINATION, HETEROLYSIS, AND ELECTRON-TRANSFER REACTIONS INVOLVING DELOCALIZED CARBOCATIONS AND CARBANIONS IN SOLUTION | 1 | 58 |
| 7716 | 1 | 46 | 9991 1985 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 107 (5): 1161-1165 ICHIKAWA H; EBISAWA Y HARTREE-FOCK MO THEORETICAL APPROACH TO AROMATICITY - INTERPRETATION OF HUCKEL RESONANCE ENERGY IN TERMS OF KINETIC-ENERGY OF PI-ELECTRONS | 5 | 39 |
| 7717 | 2 | 34 | 9992 1985 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 107 (8): 2319-2323 INOUE Y; HOSHI H; SAKURAI M; CHUJO R GEOMETRY OF CYCLOHEXAAMYLOSE INCLUSION COMPLEXES WITH SOME SUBSTITUTED BENZENES IN AQUEOUS-SOLUTION BASED ON C-13 NMR CHEMICAL-SHIFTS | 2 | 77 |
| 7718 | 5 | 19 | 9993 1985 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 107 (13): 3786-3788 GERSTEN JI; SAPSE AM GENERALIZATION OF THE BORN EQUATION TO NONSPHERICAL SOLVENT CAVITIES | 10 | 23 |
| 7719 | 1 | 40 | 9994 1985 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 107 (25): 7344-7351 ZALOUDEK F; NOVROS JS; CLARK LB THE ELECTRONIC-SPECTRUM OF CYTOSINE | 2 | 49 |
| 7720 | 7 | 73 | 10278 1986 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 108 (9): 2140-2146 ECKERT H; YESINOWSKI JP S-33 NMR AT NATURAL ABUNDANCE IN SOLIDS | 0 | 21 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7721 | 5 | 17 | 10279 1986 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 108 (17): 5109-5113 CLARK LB TRANSITION-MOMENT DIRECTIONS OF PROTONATED 1-METHYLCYTOSINE | 0 | 6 |
| 7722 | 0 | 29 | 10534 1987 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 109 (10): 2884-2887 POLAK M; GRUEBELE M; SAYKALLY RJ VELOCITY MODULATION LASER SPECTROSCOPY OF NEGATIVE-IONS - THE NU-3, BAND OF AZIDE (N3-) | 0 | 43 |
| 7723 | 2 | 59 | 10785 1988 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 110 (21): 6947-6954 CHAKRABORTY AK; BISCHOFF KB; ASTARITA G; DAMEWOOD JR MOLECULAR-ORBITAL APPROACH TO SUBSTITUENT EFFECTS IN AMINE-CO2 INTERACTIONS | 0 | 11 |
| 7724 | 5 | 222 | 10786 1988 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 110 (22): 7302-7315 WHEELER RA; PIELA L; HOFFMANN R A RECIPROCAL SPACE APPROACH TO THE ORBITALS OF TRUNCATED CRYSTALS | 1 | 13 |
| 7725 | 1 | 79 | 11049 1989 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 111 (3): 900-906 SHIN SK; BEAUCHAMP JL PRECISE DETERMINATION OF STABILITIES OF PRIMARY, SECONDARY, AND TERTIARY SILICENIUM IONS FROM KINETICS AND EQUILIBRIA OF HYDRIDE-TRANSFER REACTIONS IN THE GAS-PHASE - A QUANTITATIVE COMPARISON OF THE STABILITIES OF SILICENIUM AND CARBONIUM-IONS IN THE GAS-PHASE | 0 | 42 |
| 7726 | 6 | 58 | 11050 1989 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 111 (5): 1547-1552 KOZAKI T; MORIHASHI K; KIKUCHI O MNDO-EFFECTIVE CHARGE MODEL STUDY OF SOLVENT EFFECT ON THE POTENTIAL-ENERGY SURFACE OF THE SN2 REACTION | 21 | 61 |
| 7727 | 2 | 48 | 11324 1990 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 112 (1): 109-114 EWIG CS; VANWAZER JR ABINITIO STUDIES OF MOLECULAR-STRUCTURES AND ENERGETICS .4. HEXACOORDINATED NF6-AND CF62-ANIONS | 0 | 31 |
| 7728 | 4 | 39 | 11325 1990 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 112 (4): 1460-1466 KRAUSS M; STEVENS WJ ANALYSIS OF PROTEIN METAL-BINDING SELECTIVITY IN A CLUSTER MODEL | 0 | 24 |
| 7729 | 1 | 41 | 11326 1990 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 112 (14): 5425-5431 GOCHELDUPUIS M; DELWICHE J; HUBINFRANSKIN MJ; COLLIN JE; EDARD F; et al. ELECTRON-ENERGY LOSS SPECTROSCOPY OF THE OUTER VALENCE SHELLS OF ACETONITRILE AND METHYL ISOCYANIDE | 0 | 2 |
| 7730 | 2 | 72 | 11327 1990 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 112 (20): 7091-7098 ODRISCOLL E; SIMON JD; PETERS KS SOLVENT EFFECTS ON THE ENERGETICS OF INTERMOLECULAR CHARGE-TRANSFER REACTIONS | 1 | 29 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7731 | 4 | 54 | 11603 1991 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 113 (5): 1770-1780 AUE DH; WEBB HM; DAVIDSON WR; TOURE P; HOPKINS HP; et al. RELATIONSHIPS BETWEEN THE THERMODYNAMICS OF PROTONATION IN THE GAS AND AQUEOUS PHASE FOR 2-SUBSTITUTED, 3-SUBSTITUTED, AND 4-SUBSTITUTED PYRIDINES | 0 | 25 |
| 7732 | 4 | 34 | 11604 1991 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 113 (7): 2481-2486 DANG LX; RICE JE; CALDWELL J; KOLLMAN PA ION SOLVATION IN POLARIZABLE WATER - MOLECULAR-DYNAMICS SIMULATIONS | 17 | 227 |
| 7733 | 2 | 52 | 11605 1991 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 113 (13): 4776-4782 WONG MW; FRISCH MJ; WIBERG KB SOLVENT EFFECTS .1. THE MEDIATION OF ELECTROSTATIC EFFECTS BY SOLVENTS | 47 | 701 |
| 7734 | 4 | 55 | 11606 1991 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 113 (21): 7837-7847 KIM Y; TRUHLAR DG; KREEVOY MM AN EXPERIMENTALLY BASED FAMILY OF POTENTIAL-ENERGY SURFACES FOR HYDRIDE TRANSFER BETWEEN NAD+ ANALOGS | 3 | 69 |
| 7735 | 1 | 69 | 11607 1991 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 113 (22): 8247-8256 CUMMINS PL; RAMNARAYAN K; SINGH UC; GREADY JE MOLECULAR-DYNAMICS FREE-ENERGY PERTURBATION STUDY ON THE RELATIVE AFFINITIES OF THE BINDING OF REDUCED AND OXIDIZED NADP TO DIHYDROFOLATE-REDUCTASE | 1 | 32 |
| 7736 | 17 | 137 | 11608 1991 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 113 (22): 8305-8311 CRAMER CJ; TRUHLAR DG GENERAL PARAMETERIZED SCF MODEL FOR FREE-ENERGIES OF SOLVATION IN AQUEOUS-SOLUTION | 60 | 374 |
| 7737 | 2 | 75 | 11609 1991 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 113 (22): 8339-8346 SHARPE P; RICHARDSON DE METAL-LIGAND BOND-ENERGIES AND SOLVATION ENERGIES FOR GAS-PHASE TRANSITION-METAL TRIS(ACETYLACETONATE) COMPLEXES AND THEIR NEGATIVE-IONS | 1 | 21 |
| 7738 | 2 | 52 | 11610 1991 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 113 (25): 9610-9614 GAO J; BOUDON S; WIPFF G ABINITIO AND CRYSTAL-STRUCTURE ANALYSIS OF LIKE-CHARGED ION-PAIRS | 0 | 35 |
| 7739 | 4 | 54 | 11902 1992 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 114 (10): 3668-3674 MIYAMOTO S; KOLLMAN PA MOLECULAR-DYNAMICS STUDIES OF CALIXSPHERAND COMPLEXES WITH ALKALI-METAL CATIONS - CALCULATION OF THE ABSOLUTE AND RELATIVE FREE-ENERGIES OF BINDING OF CATIONS TO A CALIXSPHERAND | 2 | 64 |
| 7740 | 4 | 40 | 11903 1992 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 114 (18): 7116-7123 KIM YH; KREEVOY MM THE EXPERIMENTAL MANIFESTATIONS OF CORNER-CUTTING TUNNELING | 0 | 34 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7741 | 2 | 61 | 11904 1992 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 114 (26): 10482-10485 RICHARDSON DE; RYAN MF; KHAN MNI; MAXWELL KA ALKYL SUBSTITUENT EFFECTS IN CYCLOPENTADIENYL METAL-COMPLEXES - TRENDS IN GAS-PHASE IONIZATION AND ELECTRON-ATTACHMENT ENERGETICS OF ALKYLNICKELOCENES | 1 | 17 |
| 7742 | 2 | 44 | 12205 1993 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 115 (7): 2903-2911 FURUKI T; HOSOKAWA F; SAKURAI M; INOUE Y; CHUJO R MICROSCOPIC MEDIUM EFFECTS ON A CHEMICAL-REACTION - A THEORETICAL-STUDY OF DECARBOXYLATION CATALYZED BY CYCLODEXTRINS AS AN ENZYME MODEL | 6 | 29 |
| 7743 | 3 | 51 | 12206 1993 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 115 (8): 3250-3262 ROUX B; KARPLUS M ION-TRANSPORT IN THE GRAMICIDIN CHANNEL - FREE-ENERGY OF THE SOLVATED RIGHT-HANDED DIMER IN A MODEL MEMBRANE | 6 | 71 |
| 7744 | 2 | 31 | 12207 1993 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 115 (9): 3519-3526 PEACHEY NM; ECKHARDT CJ ENERGETICS OF ORGANIC SOLID-STATE REACTIONS - THE TOPOCHEMICAL PRINCIPLE AND THE MECHANISM OF THE OLIGOMERIZATION OF THE 2,5-DISTYRYLPYRAZINE MOLECULAR-CRYSTAL | 2 | 20 |
| 7745 | 1 | 43 | 12208 1993 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 115 (12): 5180-5184 KIKUCHI K; SATO C; WATABE M; IKEDA H; TAKAHASHI Y; et al. NEW ASPECTS ON FLUORESCENCE QUENCHING BY MOLECULAR-OXYGEN | 3 | 37 |
| 7746 | 2 | 103 | 12209 1993 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 115 (12): 5193-5203 ROZENSHTEIN V; ZILBER G; RABINOVITZ M; LEVANON H IRREGULAR PHOTOINDUCED ELECTRON-TRANSFER BETWEEN DOUBLY-CHARGED PYRENE AND ALKALI-METAL CATIONS STUDIED BY FOURIER-TRANSFORM ELECTRON-PARAMAGNETIC-RESONANCE | 1 | 17 |
| 7747 | 7 | 79 | 12210 1993 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 115 (13): 5657-5664 THOMPSON PA; SIMON JD ELECTROLYTE EFFECTS ON THE ENERGETICS AND DYNAMICS OF INTERMOLECULAR ELECTRON-TRANSFER REACTIONS | 2 | 19 |
| 7748 | 17 | 138 | 12211 1993 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 115 (20): 9174-9181 RAUHUT G; CLARK T; STEINKE T A NUMERICAL SELF-CONSISTENT REACTION FIELD (SCRF) MODEL FOR GROUND AND EXCITED-STATES IN NDDO-BASED METHODS | 14 | 118 |
| 7749 | 10 | 110 | 12520 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (4): 1502-1513 BUONO RA; VENANZI TJ; ZAUHAR RJ; LUZHKOV VB; VENANZI CA MOLECULAR-DYNAMICS AND STATIC SOLVATION STUDIES OF AMILORIDE | 1 | 11 |
| 7750 | 1 | 14 | 12521 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (6): 2689-2690 BALBUENA PB; JOHNSTON KP; ROSSKY PJ MOLECULAR SIMULATION OF A CHEMICAL-REACTION IN SUPERCRITICAL WATER | 4 | 54 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7751 | 5 | 66 | 12522 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (11): 4898-4909 NAGY PI; DURANT GJ; HOSS WP; SMITH DA THEORETICAL ANALYSES OF THE TAUTOMERIC AND CONFORMATIONAL EQUILIBRIA OF HISTAMINE AND (ALPHA-R,BETA-S)-ALPHA,BETA-DIMETHYLHISTAMINE IN THE GAS-PHASE AND AQUEOUS-SOLUTION | 1 | 42 |
| 7752 | 1 | 65 | 12523 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (13): 5714-5721 SPASOJEVIC I; BATINICHABERLE I; CHOO PL; CRUMBLISS AL SUPRAMOLECULAR ASSEMBLY FORMATION OF FERRIOXAMINE-B AND ITS AL(III), GA(III), AND IN(III) ANALOGS WITH DICYCLOHEXANO-18-CROWN-6 IN CHLOROFORM | 1 | 21 |
| 7753 | 4 | 73 | 12524 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (14): 6070-6080 ROSS WS; HARDIN CC ION-INDUCED STABILIZATION OF THE G-DNA QUADRUPLEX - FREE-ENERGY PERTURBATION STUDIES | 0 | 54 |
| 7754 | 0 | 73 | 12525 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (16): 7210-7217 BORN M; INGEMANN S; NIBBERING NMM HEATS OF FORMATION OF MONO-HALOGEN-SUBSTITUTED CARBENES - STABILITY AND REACTIVITY OF CHX(CENTER-DOT-) (X=F, CL, PR, AND I) RADICAL-ANIONS | 5 | 41 |
| 7755 | 2 | 30 | 12526 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (20): 9182-9186 VAUTHEY E; PARKER AW; NOHOVA B; PHILLIPS D TIME-RESOLVED RESONANCE RAMAN-STUDY OF THE RATE OF SEPARATION OF A GEMINATE ION-PAIR INTO FREE IONS IN A MEDIUM POLARITY SOLVENT | 0 | 11 |
| 7756 | 10 | 77 | 12527 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (24): 11048-11051 WHEELER RA A METHOD FOR COMPUTING ONE-ELECTRON REDUCTION POTENTIALS AND ITS APPLICATION TO P-BENZOQUINONE IN WATER AT 300-K | 2 | 25 |
| 7757 | 10 | 93 | 12528 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (24): 11098-11108 SHARPE P; ALAMEDDIN NG; RICHARDSON DE ALKYL SUBSTITUENT EFFECTS IN THE REDOX THERMOCHEMISTRY OF COORDINATION-COMPOUNDS - OXIDATION AND REDUCTION ENERGETICS FOR RUTHENIUM TRIS(BETA-DIKETONATE) COMPLEXES IN SOLUTION AND THE GAS-PHASE | 0 | 6 |
| 7758 | 2 | 34 | 12529 1994 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 116 (25): 11449-11455 WINDUS TL; SCHMIDT MW; GORDON MS THEORETICAL INVESTIGATION OF AZAPHOSPHATRANE BASES | 0 | 12 |
| 7759 | 11 | 70 | 12853 1995 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 117 (3): 1057-1068 GIESEN DJ; STORER JW; CRAMER CJ; TRUHLAR DG GENERAL SEMIEMPIRICAL QUANTUM-MECHANICAL SOLVATION MODEL FOR NONPOLAR SOLVATION FREE-ENERGIES - N-HEXADECANE | 11 | 82 |
| 7760 | 5 | 74 | 12854 1995 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 117 (9): 2441-2452 LUTY T; ECKHARDT CJ GENERAL THEORETICAL CONCEPTS FOR SOLID-STATE REACTIONS - QUANTITATIVE FORMULATION OF THE REACTION CAVITY, STERIC COMPRESSION, AND REACTION-INDUCED STRESS USING AN ELASTIC MULTIPOLE REPRESENTATION OF CHEMICAL PRESSURE | 3 | 42 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7761 | 4 | 141 | 12855 1995 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 117 (15): 4240-4260 WOLFE S; KIM CK; YANG K; WEINBERG N; SHI Z HYDRATION OF THE CARBONYL GROUP - A THEORETICAL-STUDY OF THE COOPERATIVE MECHANISM | 0 | 44 |
| 7762 | 4 | 81 | 12856 1995 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 117 (15): 4261-4270 WIBERG KB; RABLEN PR; RUSH DJ; KEITH TA AMIDES .3. EXPERIMENTAL AND THEORETICAL-STUDIES OF THE EFFECT OF THE MEDIUM ON THE ROTATIONAL BARRIERS FOR N,N-DIMETHYLFORMAMIDE AND N,N-DIMETHYLACETAMIDE | 4 | 201 |
| 7763 | 4 | 39 | 12857 1995 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 117 (26): 6954-6960 DANG LX MECHANISM AND THERMODYNAMICS OF ION SELECTIVITY IN AQUEOUS-SOLUTIONS OF 18-CROWN-6 ETHER - A MOLECULAR-DYNAMICS STUDY | 4 | 57 |
| 7764 | 4 | 73 | 13202 1996 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 118 (12): 2998-3005 Chipot C; Maigret B; Pearlman DA; Kollman PA Molecular dynamics potential of mean force calculations: A study of the toluene-ammonium pi-cation interactions | 0 | 52 |
| 7765 | 3 | 67 | 13203 1996 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 118 (49): 12376-12390 Beissel T; Birkelbach F; Bill E; Glaser T; Kesting F; et al. Exchange and double-exchange phenomena in linear homo-and heterotrinuclear nickel(II,III,IV) complexes containing six mu(2)- phenolato or mu(2)-thiophenolato bridging ligands | 0 | 43 |
| 7766 | 14 | 49 | 13510 1997 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 119 (25): 5946-5953 Biswas R; Bagchi B Limiting ionic conductance of symmetrical, rigid ions in aqueous solutions: Temperature dependence and solvent isotope effects | 11 | 24 |
| 7767 | 3 | 40 | 13511 1997 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 119 (31): 7374-7380 Lunell S; Stashans A; Ojamae L; Lindstrom H; Hagfeldt A Li and Na diffusion in TiO2 from quantum chemical theory versus electrochemical experiment | 4 | 38 |
| 7768 | 2 | 25 | 13512 1997 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 119 (34): 8023-8030 Nagaoka M; Suenobu K; Yamabe T On the hydronium ion catalyzed mechanism in vinyl alcohol acetaldehyde isomerization: Ab initio molecular orbital theory and Monte Carlo simulation | 0 | 4 |
| 7769 | 7 | 39 | 13513 1997 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 119 (36): 8523-8527 Hummer G; Pratt LR; Garcia AE Multistate Gaussian model for electrostatic solvation free energies | 4 | 24 |
| 7770 | 4 | 44 | 13514 1997 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 119 (40): 9331-9335 Michels PC; Dordick JS; Clark DS Dipole formation and solvent electrostriction in subtilisin catalysis | 0 | 14 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7771 | 2 | 37 | 13854 1998 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 120 (7): 1571-1580 Schaad LJ; Hu JA Symmetry rules for transition structures in degenerate reactions | 0 | 7 |
| 7772 | 2 | 39 | 13855 1998 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 120 (9): 2204-2205 Kondru RK; Wipf P; Beratan DN Theory-assisted determination of absolute stereochemistry for complex natural products via computation of molar rotation angles | 3 | 49 |
| 7773 | 2 | 33 | 13856 1998 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 120 (30): 7537-7543 Gregoire F; Wei SH; Streed EW; Brameld KA; Fort D; et al. Conformational equilibria of beta-alanine and related compounds as studied by NMR spectroscopy | 2 | 17 |
| 7774 | 5 | 73 | 13857 1998 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 120 (34): 8812-8824 Blomberg MRA; Siegbahn PEM; Babcock GT Modeling electron transfer in biochemistry: A quantum chemical study of charge separation in Rhodobacter sphaeroides and photosystem II | 0 | 92 |
| 7775 | 13 | 34 | 13858 1998 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 120 (46): 12041-12050 Koneshan S; Lynden-Bell RM; Rasaiah JC Friction coefficients of ions in aqueous solution at 25 degrees C | 4 | 22 |
| 7776 | 5 | 47 | 14223 1999 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 121 (20): 4804-4815 Nagy PI; Alagona G; Ghio C Theoretical studies on the conformation of protonated dopamine in the gas phase and in aqueous solution | 0 | 18 |
| 7777 | 3 | 40 | 14224 1999 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 121 (31): 7211-7219 Inada TN; Miyazawa CS; Kikuchi K; Yamauchi M; Nagata T; et al. Effects of molecular charge on photoinduced electron-transfer reactions | 0 | 22 |
| 7778 | 7 | 128 | 14225 1999 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 121 (43): 10157-10167 Chuang YY; Truhlar DG Nonequilibrium solvation effects for a polyatomic reaction in solution | 1 | 13 |
| 7779 | 3 | 141 | 14226 1999 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 121 (49): 11516-11530 Kim NS; Zhu QQ; LeBreton PR Aqueous ionization and electron-donating properties of dinucleotides: Sequence-specific electronic effects on DNA alkylation | 1 | 28 |
| 7780 | 2 | 35 | 14897 2001 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 123 (23): 5495-5506 Mylvaganam K; Bacskay GB; Hush NS Protonation-induced paramagnetism. Structures and stabilities of six-and seven-coordinate complexes of Os(II) in singlet and triplet states: A density functional study | 0 | 1 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7781 | 1 | 35 | 14898 2001 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 123 (31): 7697-7702 Baldelli S; Mailhot G; Ross PN; Somorjai GA Potential-dependent vibrational spectroscopy of solvent molecules at the Pt(111) electrode in a water/acetonitrile mixture studied by sum frequency generation | 0 | 9 |
| 7782 | 1 | 17 | 15254 2002 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 124 (10): 2128-2129 Venuti E; Della Valle RG; Brillante A; Masino M; Girlando A Probing pentacene polymorphs by lattice dynamics calculations | 1 | 21 |
| 7783 | 3 | 35 | 15255 2002 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 124 (16): 4481-4486 Kent DR; Petterson KA; Gregoire F; Snyder-Frey E; Hanely LJ; et al. An NMR and quantum-mechanical investigation of tetrahydrofuran solvent effects on the conformational equilibria of 1,4-butanedioic acid and its salts | 0 | 6 |
| 7784 | 2 | 52 | 15256 2002 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 124 (43): 12796-12805 Blas JR; Marquez M; Sessler JL; Luque FJ; Orozco M Theoretical study of anion binding to calix[4]pyrrole: the effects of solvent, fluorine substitution, cosolute, and water traces | 0 | 16 |
| 7785 | 3 | 87 | 15597 2003 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 125 (11): 3273-3283 Gwaltney SR; Rosokha SV; Head-Gordon M; Kochi JK Charge-transfer mechanism for electrophilic aromatic nitration and nitrosation via the convergence of (ab initio) molecular-orbital and Marcus-Hush theories with experiments | 0 | 9 |
| 7786 | 2 | 65 | 15598 2003 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 125 (17): 5176-5185 Bell RC; Wang HF; Iedema MJ; Cowin JP Nanometer-resolved interfacial fluidity | 1 | 4 |
| 7787 | 3 | 60 | 15599 2003 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 125 (25): 7664-7677 Cremer C; Burger P Magnetic properties of cationic tungsten(IV) half sandwich compounds: Experimental and theoretical study of a solvent and ligand stabilized singlet ground state leading to a thermally induced singlet-triplet spin state interconversion | 0 | 1 |
| 7788 | 2 | 68 | 15600 2003 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 125 (31): 9318-9328 Babu CS; Dudev T; Casareno R; Cowan JA; Lim C A combined experimental and theoretical study of divalent metal ion selectivity and function in proteins: Application to E-coli ribonuclease H1 | 0 | 4 |
| 7789 | 22 | 114 | 15601 2003 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 125 (50): 15671-15682 Grossfield A; Ren PY; Ponder JW Ion solvation thermodynamics from simulation with a polarizable force field | 1 | 14 |
| 7790 | 7 | 63 | 15927 2004 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 126 (13): 4132-4144 Reimers JR; Hush NS Unified description of the electrochemical, charge distribution, and spectroscopic properties of the special-pair radical cation in bacterial photosynthesis | 0 | 4 |
| # | LCR | NCR | Node / Date / Journal / Author | LCS | GCS |
| 7791 | 11 | 72 | 15928 2004 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 126 (32): 10152-10161 Kerisit S; Parker SC Free energy of adsorption of water and metal ions on the {1014} calcite surface | 1 | 2 |
| 7792 | 2 | 84 | 16146 2005 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 127 (18): 6641-6651 Sheth AR; Lubach JW; Munson EJ; Muller FX; Grant DJW Mechanochromism of piroxicam accompanied by intermolecular proton transfer probed by spectroscopic methods and solid-phase changes | 0 | 0 |
| 7793 | 7 | 79 | 16147 2005 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 127 (19): 7203-7214 Winter B; Weber R; Hertel IV; Faubel M; Jungwirth P; et al. Electron binding energies of aqueous alkali and halide ions: EUV photoelectron spectroscopy of liquid solutions and combined ab initio and molecular dynamics calculations | 0 | 0 |
| 7794 | 5 | 37 | 7894 1978 JOURNAL OF THE AMERICAN SOCIETY FOR INFORMATION SCIENCE 29 (5): 225-231 OPPENHEIM C; RENN SP HIGHLY CITED OLD PAPERS AND REASONS WHY THEY CONTINUE TO BE CITED | 0 | 37 |
| 7795 | 0 | 40 | 12858 1995 JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY 6 (1): 71-75 BORN M; INGEMANN S; NIBBERING NMM FORMATION AND CHARACTERIZATION OF THE SULFUR-CONTAINING DISTONIC RADICAL-ANION, CH(2)-S-(C)OVER-BAR-H-CN, IN THE GAS-PHASE | 4 | 15 |
| 7796 | 2 | 36 | 6351 1973 JOURNAL OF THE AMERICAN SOCIETY FOR PSYCHICAL RESEARCH 67 (4): 341-360 WHITEMAN JH QUANTUM THEORY AND PARAPSYCHOLOGY | 0 | 2 |
| 7797 | 5 | 66 | 10535 1987 JOURNAL OF THE AMERICAN SOCIETY FOR PSYCHICAL RESEARCH 81 (4): 333-369 WALKER EH MEASUREMENT IN QUANTUM-MECHANICS REVISITED - A RESPONSE TO PHILLIPS CRITICISM OF THE QUANTUM-MECHANICAL THEORY OF PSI | 0 | 2 |
| 7798 | 0 | 25 | 6981 1975 JOURNAL OF THE AMERICAN STATISTICAL ASSOCIATION 70 (349): 7-14 CORNFIELD J STATISTICIANS APOLOGY - PRESIDENTIAL-ADDRESS | 0 | 16 |
| 7799 | 0 | 10 | 3508 1963 JOURNAL OF THE ATMOSPHERIC SCIENCES 20 (2): 153-158 BERG TGO; FERNISH GC; GAUKLER TA THE MECHANISM OF COALESCENCE OF LIQUID DROPS | 0 | 9 |
| 7800 | 4 | 66 | 14543 2000 JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY 11 (2): 112-120 Rocha WR; de Almeida WB On the cis -> trans isomerization of the square-planar [Pt(Cl)(SnCl3)(PH3)(2)] compound: Ab initio gas phase reaction mechanism and solvent effects using continuum models | 0 | 3 |
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