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Thu Aug 18 17:26:22 2005
Papers and Books by Carl Djerassi
and the papers citing C Djerassi

Nodes: 29221, Authors: 40665, Journals: 1485, Outer References: 554040, Words: 41910
Collection span: 1946 - 2005
View: Overview. Sorted by journal name. Page 111 of 293:  1  |  101  [  111  112  113  114  115  116  117  118  119  120 ]  121   131   141   151   161   171   181   191  |  201 

#LCRNCRNode / Date / Journal / AuthorLCSGCS
110011922825920 1995 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 35 (3): 339-350
BALABAN AT
CHEMICAL GRAPHS - LOOKING BACK AND GLIMPSING AHEAD
033
1100232825921 1995 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 35 (3): 479-493
MATA P; GILLET VJ; JOHNSON AP; LAMPREIA J; MYATT GJ; et al.
SPROUT - 3D STRUCTURE GENERATION USING TEMPLATES
114
11003163325922 1995 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 35 (3): 494-503
BOHANEC S
STRUCTURE GENERATION BY THE COMBINATION OF STRUCTURE REDUCTION AND STRUCTURE ASSEMBLY
25
1100433325923 1995 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 35 (5): 806-814
WEST GMJ
PREDICTING PHOSPHORUS NUCLEAR-MAGNETIC-RESONANCE (NMR) SHIFTS USING NEURAL NETWORKS .3. ELEMENT-VALUE OPTIMIZING (EVO) NETWORK ARCHITECTURES
06
1100525325924 1995 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 35 (6): 945-955
ZHU QW; STILLMAN MJ
DESIGN OF AN EXPERT-SYSTEM FOR EMERGENCY RESPONSE TO A CHEMICAL SPILL .1. DOMAIN DEFINITION AND KNOWLEDGE ACQUISITION
12
1100693225925 1995 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 35 (6): 1068-1073
NUZILLARD JM; NAANAA W; PIMONT S
APPLYING THE CONSTRAINT SATISFACTION PROBLEM PARADIGM TO STRUCTURE GENERATION
69
1100782326309 1996 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 36 (2): 221-227
Will M; Fachinger W; Richert JR
Fully automated structure elucidation - A spectroscopist's dream comes true
1838
1100864826310 1996 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 36 (2): 323-333
Varmuza K; Werther W
Mass spectral classifiers for supporting systematic structure elucidation
324
1100993726311 1996 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 36 (3): 413-419
Wieland T; Kerber A; Laue R
Principles of the generation of constitutional and configurational isomers
824
110101015926312 1996 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 36 (3): 497-509
Zhu QW; Stillman MJ
Expert systems and analytical chemistry: Recent progress in the ACexpert project
04
#LCRNCRNode / Date / Journal / AuthorLCSGCS
1101111026313 1996 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 36 (4): 854-856
Yeh CY
Isomer enumeration of alkenes and aliphatic cyclopropane derivatives
38
11012155226314 1996 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 36 (4): 888-899
Molchanova MS; Shcherbukhin VV; Zefirov NS
Computer generation of molecular structures by the SMOG program
411
1101332926683 1997 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 37 (2): 329-334
Klopman G; Tu MH; Talafous J
META .3. A genetic algorithm for metabolic transform priorities optimization
013
110146926684 1997 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 37 (2): 403-404
Will M; Richert J
SpecSolv - An innovation at work
01
11015183326685 1997 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 37 (5): 879-883
Schriber H; Pretsch E
General characteristics of good-list and bad-list entries for structure generators from spectra
13
11016175527079 1998 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 38 (1): 8-22
Molchanova MS; Zefirov NS
Irredundant generation of isomeric molecular structures with some known fragments
24
1101751027080 1998 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 38 (2): 100-107
Carabedian M; Dubois JE
Large virtual enhancement of a C-13 NMR database. A structural crowning extrapolation method enabling spectral data transfer
12
1101813227081 1998 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 38 (6): 951-955
Meyer E; Funkhouser NF
A brief history of networking in the US
01
11019338027082 1998 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 38 (6): 997-1009
Munk ME
Computer-based structure determination: Then and now
1028
11020610227083 1998 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 38 (6): 1063-1078
Bytautas L; Klein DJ
Chemical combinatorics for alkane-isomer enumeration and more
321
#LCRNCRNode / Date / Journal / AuthorLCSGCS
11021144927440 1999 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 39 (3): 475-482
Contreras ML; Trevisiol GM; Alvarez J; Arias G; Rozas R
Exhaustive generation of organic isomers. 5. Unsaturated optical and geometrical stereoisomers and a new CIP subrule
210
1102222327441 1999 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 39 (3): 563-568
Lukovits I
Isomer generation: Syntactic rules for detection of isomorphism
04
1102315827442 1999 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 39 (6): 1017-1026
Rusinko A; Farmen MW; Lambert CG; Brown PL; Young SS
Analysis of a large structure/biological activity data set using recursive partitioning
069
11024123528064 2001 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 41 (4): 964-977
Contreras ML; Alvarez J; Riveros M; Arias G; Rozas R
Exhaustive generation of organic isomers. 6. Stereoisomers having isolated and spiro cycles and new extended N_tuples
02
1102584428065 2001 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 41 (4): 1046-1052
Yao JH; Fan BT; Doucet JP; Panaye A; Yuan SG; et al.
SIRS-SS: A system for simulating IR/Raman spectra. 1. Substructure/subspectrum correlation
03
11026132428344 2002 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 42 (3): 614-619
Fontana P; Pretsch E
Automatic spectra interpretation, structure generation, and ranking
03
11027103028621 2003 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 43 (5): 1434-1446
Korytko A; Schulz KP; Madison MS; Munk ME
HOUDINI: A new approach to computer-based structure generation
13
1102831528879 2004 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 44 (1): 286-288
Carmack M
Chirality of the disulfide in the prion proteins
00
1102941628880 2004 JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 44 (5): 1654-1665
Rucker C; Gugisch R; Kerber A
Manual construction and mathematics-and computer-aided counting of stereoisomers. The example of oligoinositols
00
110303452269 1962 JOURNAL OF CHEMICAL PHYSICS 37 (9): 2114-&
SCHELLMAN JA; ORIEL P
ORIGIN OF COTTON EFFECT OF HELICAL POLYPEPTIDES
46152
#LCRNCRNode / Date / Journal / AuthorLCSGCS
110311432784 1963 JOURNAL OF CHEMICAL PHYSICS 39 (6): 1493-&
KARPLUS M; KOLKER HJ
A VARIATION-PERTURBATION APPROACH TO INTERACTION OF RADIATION WITH ATOMS AND MOLECULES
2186
110321233333 1964 JOURNAL OF CHEMICAL PHYSICS 40 (9): 2565-&
BEASLEY EE; ANDERSON RS
ELECTRON SPIN RESONANCE OF ULTRAVIOLET-IRRADIATED COMPOUNDS .2. PEROXIDE-INITIATED RADICALS IN STRAIGHT CHAIN ALKENES
04
110333373334 1964 JOURNAL OF CHEMICAL PHYSICS 41 (5): 1435-&
WEIGANG O
SOLVENT FIELD CORRECTIONS FOR ELECTRIC DIPOLE + ROTATORY STRENGTHS
047
11034294013 1965 JOURNAL OF CHEMICAL PHYSICS 42 (6): 2244-&
WEIGANG OE
VIBRATIONAL STRUCTURING IN CIRCULAR DICHROISM
036
110351164014 1965 JOURNAL OF CHEMICAL PHYSICS 43 (1): 71-&
WEIGANG OE
VIBRATIONAL STRUCTURING IN OPTICAL ACTIVITY .I. VIBRONIC COUPLING IN CIRCULAR DICHROISM OF DIMERS
040
110363324015 1965 JOURNAL OF CHEMICAL PHYSICS 43 (10P1): 3609-&
WEIGANG OE
VIBRATIONAL STRUCTURING IN OPTICAL ACTIVITY .2. FORBIDDEN CHARACTER IN CIRCULAR DICHROISM
68159
110375184824 1966 JOURNAL OF CHEMICAL PHYSICS 44 (1): 55-&
SCHELLMA.JA
SYMMETRY RULES FOR OPTICAL ROTATION
0244
110381194825 1966 JOURNAL OF CHEMICAL PHYSICS 44 (5): 2082-&
LEWIS IC; SINGER LS
ELECTRON SPIN RESONANCE OF RADICAL IONS OF AN ISOMERIC ALTERNANT AND NONALTERNANT AROMATIC HYDROCARBON
117
110396564826 1966 JOURNAL OF CHEMICAL PHYSICS 44 (12): 4592-&
STEPHENS PJ; SUETAAK W; SCHATZ PN
MAGNETO-OPTICAL ROTATORY DISPERSION OF PORPHYRINS AND PHTHALOCYANINES
68159
110401154827 1966 JOURNAL OF CHEMICAL PHYSICS 45 (8): 2894-&
TSUJI K; YOSHIDA H; HAYASHI K
ESR STUDY OF IRRADIATED PYRIDINE
020
#LCRNCRNode / Date / Journal / AuthorLCSGCS
110411135650 1967 JOURNAL OF CHEMICAL PHYSICS 47 (12): 5054-&
DUGGER DL; KISER RW
METASTABLE TRANSITIONS OBSERVED IN A TIME-OF-FLIGHT MASS SPECTROMETER
010
110423546547 1968 JOURNAL OF CHEMICAL PHYSICS 48 (1): 132-&
STEPHENS PJ; SCHATZ PN; RITCHIE AB; MCCAFFER.AJ
MAGNETIC CIRCULAR DICHROISM OF BENZENE TRIPHENYLENE AND CORONENE
3165
1104314536548 1968 JOURNAL OF CHEMICAL PHYSICS 48 (3): 1127-&
HOHN EG; WEIGANG OE
ELECTRON CORRELATION MODELS FOR OPTICAL ACTIVITY
80190
110449336549 1968 JOURNAL OF CHEMICAL PHYSICS 48 (7): 3115-&
BOUMAN TD; MOSCOWIT.A
OPTICAL ACTIVITY OF SATURATED KETONES
2836
110451386550 1968 JOURNAL OF CHEMICAL PHYSICS 48 (10): 4398-&
BRILL AS; BRYCE GF
CUPRIC ION IN BLUE PROTEINS
265
110465466551 1968 JOURNAL OF CHEMICAL PHYSICS 49 (7): 3257-&
DEUTSCHE CW; MOSCOWIT.A
OPTICAL ACTIVITY OF VIBRATIONAL ORIGIN .I. A MODEL HELICAL POLYMER
984
110473197566 1969 JOURNAL OF CHEMICAL PHYSICS 50 (6): 2716-&
BOCCARA AC; FERRE J; BRIAT B; BILLARDO.M; BADOZ JP
COTTON-MOUTON EFFECT THROUGH AN ABSORPTION BAND
316
110484617567 1969 JOURNAL OF CHEMICAL PHYSICS 50 (12): 5336-&
CHIU YN
HIGHER ASYMMETRY IN OPTICAL ROTATION
220
110497367568 1969 JOURNAL OF CHEMICAL PHYSICS 51 (8): 3397-&
STIGTER D; SCHELLMA.JA
APPROXIMATIONS IN ONE-ELECTRON THEORY OF OPTICAL ROTATION
615
110506428459 1970 JOURNAL OF CHEMICAL PHYSICS 52 (3): 1042-&
CHIU YN
TEMPERATURE-DEPENDENT OPTICAL ACTIVITY DUE TO QUANTIZED MOLECULAR ROTATION AND OPTICAL ROTATION BY ORIENTED MOLECULES
531
#LCRNCRNode / Date / Journal / AuthorLCSGCS
110511268460 1970 JOURNAL OF CHEMICAL PHYSICS 52 (12): 6174-&
BUTTRILL SE
CALCULATION OF ION-MOLECULE REACTION PRODUCT DISTRIBUTIONS USING QUASIEQUILIBRIUM THEORY OF MASS SPECTRA
429
110522508461 1970 JOURNAL OF CHEMICAL PHYSICS 53 (3): 1134-&
DEUTSCHE CW
THEORY OF OPTICAL ACTIVITY OF CRYSTALLINE BENZIL
110
110534338462 1970 JOURNAL OF CHEMICAL PHYSICS 53 (9): 3522-&
BUSH CA
OPTICAL ACTIVITY OF N-PI! TRANSITIONS IN POLYNUCLEOTIDES
213
1105411308463 1970 JOURNAL OF CHEMICAL PHYSICS 53 (11): 4152-&
HOWELL JM
ANALYSIS OF ROTATORY STRENGTH FOR SOME MODEL ALDEHYDES
610
110553199436 1971 JOURNAL OF CHEMICAL PHYSICS 54 (7): 2888-&
SUTHERLA.JC; AXELROD D; KLEIN MP
ZEEMAN EFFECT IN PORPHYRINS - ZERO-FIELD SPLITTING OF EXCITED ELECTRONIC STATES
039
110564239437 1971 JOURNAL OF CHEMICAL PHYSICS 55 (1): 224-&
STEPHENS PJ; MOWERY RL; SCHATZ PN
MOMENT ANALYSIS OF MAGNETIC CIRCULAR DICHROISM - DIAMAGNETIC MOLECULAR SOLUTIONS
1853
110576269438 1971 JOURNAL OF CHEMICAL PHYSICS 55 (12): 5668-&
LARKINDA.JP; SIMKIN DJ
MAGNETIC CIRCULAR DICHROISM OF ALPHA-BANDS OF SOME POLYCYCLIC AROMATIC HYDROCARBONS
056
110582299439 1971 JOURNAL OF CHEMICAL PHYSICS 55 (12): 5711-&
HARNUNG SE; ONG EC; WEIGANG OE
LOW-RESOLUTION ANALYSIS OF VIBRATIONAL-ELECTRONIC CIRCULAR DICHROISM SPECTRA
1033
1105931810466 1972 JOURNAL OF CHEMICAL PHYSICS 57 (9): 3821-&
ZANDSTRA PJ; SCHOLTEN.DJ; KONING RE
MAGNETIC CIRCULAR-DICHROISM OF CORONENE MONONEGATIVE AND DINEGATIVE IONS
1223
1106053511439 1973 JOURNAL OF CHEMICAL PHYSICS 58 (5): 2135-2144
DEARMAN HH
MAGNETIC CIRCULAR-DICHROISM OF AROMATIC CARBONYL-COMPOUNDS
711
#LCRNCRNode / Date / Journal / AuthorLCSGCS
11061211011440 1973 JOURNAL OF CHEMICAL PHYSICS 59 (9): 4984-5002
HUDSON BS; KOHLER BE
POLYENE SPECTROSCOPY - LOWEST ENERGY EXCITED SINGLET-STATE OF DIPHENYLOCTATETRAENE AND OTHER LINEAR POLYENES
2324
110623712373 1974 JOURNAL OF CHEMICAL PHYSICS (12): 481-482
SEGAL R; REICHER F; YOUSSEFY.RD
CONFIGURATION OF ECHINOCYSTIC AND COCHALIC ACIDS
46
1106362012374 1974 JOURNAL OF CHEMICAL PHYSICS 60 (2): 703-704
WARNICK SM; MICHL J
MAGNETIC CIRCULAR-DICHROISM - SEMIEMPIRICAL CALCULATION OF B TERMS USING PERTURBATION FORMULA
919
1106463312375 1974 JOURNAL OF CHEMICAL PHYSICS 60 (5): 1943-1951
LINDER RE; BUNNENBE.E; SEAMANS L; MOSCOWIT.A
CALCULATION OF VIBRONIC MAGNETIC ROTATIONAL STRENGTHS IN FORMALDEHYDE
1734
1106543212376 1974 JOURNAL OF CHEMICAL PHYSICS 61 (4): 1305-1314
KIM KC; BEYNON JH; COOKS RG
ENERGY PARTITIONING BY MASS-SPECTROMETRY - CHLOROALKANES AND CHLOROALKENES
1352
1106674412377 1974 JOURNAL OF CHEMICAL PHYSICS 61 (6): 2427-2437
ROSENFIE.JS; MOSCOWIT.A; LINDER RE
VIBRONIC MAGNETIC ROTATIONAL STRENGTHS IN B2-UPSILON STATE OF BENZENE
024
1106712713326 1975 JOURNAL OF CHEMICAL PHYSICS 62 (4): 1566-1571
BOHREN CF
SCATTERING OF ELECTROMAGNETIC-WAVES BY AN OPTICALLY-ACTIVE SPHERICAL-SHELL
142
1106824213327 1975 JOURNAL OF CHEMICAL PHYSICS 63 (2): 613-623
TREU JI; HOPFIELD JJ
MAGNETIC CIRCULAR-DICHROISM IN HEMOGLOBIN
1737
1106912013328 1975 JOURNAL OF CHEMICAL PHYSICS 63 (10): 4152-4158
KAO JWH; CHUNGPHILLIPS A
BONDED AND NONBONDED INTERACTIONS IN SATURATED ALCOHOLS, ETHERS, THIOLS, THIOETHERS, AND AMINES
216
1107023113329 1975 JOURNAL OF CHEMICAL PHYSICS 63 (10): 4317-4328
YARKONY DR; SCHAEFER HF
ACETYL CATION AND ITS GEOMETRICAL ISOMERS
144
#LCRNCRNode / Date / Journal / AuthorLCSGCS
1107112914220 1976 JOURNAL OF CHEMICAL PHYSICS 64 (3): 1156-1165
SHELNUTT JA; OSHEA DC; YU NT; CHEUNG LD; FELTON RH
RESONANCE RAMAN-SPECTRA OF MANGANESE (III) ETIOPORPHYRIN-I
481
1107272914221 1976 JOURNAL OF CHEMICAL PHYSICS 64 (4): 1276-1280
LIVSHITZ MA; ARUTYUNYAN AM; SHARONOV YA
SPIN-ORBIT-COUPLING IN EXCITED-STATES OF FERRICYTOCHROME-C AND DEOXYHEMOGLOBIN STUDIED BY MAGNETIC CIRCULAR-DICHROISM
716
1107323114222 1976 JOURNAL OF CHEMICAL PHYSICS 65 (11): 4455-4461
SCALA AA; SALOMON D
GAS-PHASE PHOTOLYSIS AND GAMMA-RADIOLYSIS OF ETHYLENIMINE
13
1107434715043 1977 JOURNAL OF CHEMICAL PHYSICS 66 (8): 3387-3398
SHELNUTT JA; CHEUNG LD; CHANG RCC; YU NT; FELTON RH
RESONANCE RAMAN-SPECTRA OF METALLOPORPHYRINS - EFFECTS OF JAHN-TELLER INSTABILITY AND NUCLEAR DISTORTION ON EXCITATION PROFILES OF STOKES FUNDAMENTALS
3156
1107512115848 1978 JOURNAL OF CHEMICAL PHYSICS 68 (6): 2679-2685
HOWARD WE; SCHLAG EW
ROTATIONAL SELECTION-RULES FOR NONRADIATIVE PROCESSES
245
1107686515849 1978 JOURNAL OF CHEMICAL PHYSICS 69 (4): 1680-1691
TEXTER J; STEVENS ES
RANDOM-PHASE CALCULATION OF CIRCULARLY DICHROIC 3000-A BAND OF (+)-D-CAMPHOR
412
11077108716641 1979 JOURNAL OF CHEMICAL PHYSICS 70 (3): 1440-1449
TEXTER J; STEVENS ES
RANDOM-PHASE CIRCULAR DICHROISM CALCULATIONS OF THE SIGMA-STAR-3]-N TRANSITION IN CHIRAL ALCOHOLS
19
1107839016642 1979 JOURNAL OF CHEMICAL PHYSICS 70 (5): 2315-2325
BIGELOW RW
ASSESSMENT OF THE ELECTRONIC-STRUCTURE OF ALKYLBENZENES
014
1107911417350 1980 JOURNAL OF CHEMICAL PHYSICS 72 (3): 1423-1427
BARTH G; LINDER RE; BUNNENBERG E; DJERASSI C; SEAMANS L; et al.
MAGNETIC CIRCULAR-DICHROISM STUDIES .57. MAGNETIC CIRCULAR-DICHROISM SPECTRUM OF CARBON-DISULFIDE
66
1108032017351 1980 JOURNAL OF CHEMICAL PHYSICS 72 (3): 1428-1434
SEAMANS L; MOSCOWITZ A; LINDER RE; BARTH G; BUNNENBERG E; et al.
MAGNETIC CIRCULAR-DICHROISM STUDIES .58. THEORETICAL-ANALYSIS OF THE MAGNETIC CIRCULAR-DICHROISM SPECTRUM OF CARBON-DISULFIDE
88
#LCRNCRNode / Date / Journal / AuthorLCSGCS
1108124118053 1981 JOURNAL OF CHEMICAL PHYSICS 74 (10): 5347-5356
SINGH RD; KEIDERLING TA
VIBRATIONAL CIRCULAR-DICHROISM OF 3-METHYLCYCLOHEXANONE - FIXED PARTIAL CHARGE CALCULATIONS
339
1108224218054 1981 JOURNAL OF CHEMICAL PHYSICS 74 (12): 6644-6657
SHELNUTT JA
A SIMPLE INTERPRETATION OF RAMAN EXCITATION-SPECTRA OF METALLOPORPHYRINS
146
1108311918055 1981 JOURNAL OF CHEMICAL PHYSICS 75 (10): 5186-5189
KLEIN DJ
RIGOROUS RESULTS FOR BRANCHED POLYMER MODELS WITH EXCLUDED VOLUME
144
1108414418778 1982 JOURNAL OF CHEMICAL PHYSICS 76 (7): 3630-3636
HO P; BAMFORD DJ; BUSS RJ; LEE YT; MOORE CB
PHOTO-DISSOCIATION OF FORMALDEHYDE IN A MOLECULAR-BEAM
089
1108575220191 1984 JOURNAL OF CHEMICAL PHYSICS 80 (12): 6299-6304
BROWN SH; CHIU YN
OPTICAL AND MAGNETO-OPTICAL ROTATION DUE TO TRANSVERSE ELECTRONIC MOTION IN THICK HELICES OF NONINTEGRAL TURNS
00
1108614920845 1985 JOURNAL OF CHEMICAL PHYSICS 82 (4): 1779-1787
OHNO O; KAIZU Y; KOBAYASHI H
LUMINESCENCE OF SOME METALLOPORPHINS INCLUDING THE COMPLEXES OF THE IIIB METAL GROUP
269
11087125721428 1986 JOURNAL OF CHEMICAL PHYSICS 85 (1): 109-133
ZGIERSKI MZ
VIBRONIC STRUCTURE OF MAGNETIC CIRCULAR-DICHROISM (MCD) SPECTRA .2. PERTURBATIONAL TREATMENT OF VIBRONIC COUPLING EFFECTS IN MOLECULES WITH NONDEGENERATE ELECTRONIC STATES
212
1108811522007 1987 JOURNAL OF CHEMICAL PHYSICS 86 (8): 4335-4340
JOHNSON LW; MURPHY MD; POPE C; FORESTI M; LOMBARDI JR
STARK-EFFECT ON THE 580-NM S1[-SO TRANSITION OF ISOBACTERIOCHLORIN USING PHOTOCHEMICAL HOLE-BURNING SPECTROSCOPY
323
1108923722521 1988 JOURNAL OF CHEMICAL PHYSICS 89 (11): 6567-6576
ASANO M; KAIZU Y; KOBAYASHI H
THE LOWEST EXCITED-STATES OF COPPER PORPHYRINS
040
1109036123079 1989 JOURNAL OF CHEMICAL PHYSICS 90 (7): 3498-3505
HANCOCK GC; TRUHLAR DG
REACTION-PATH ANALYSIS OF THE EFFECT OF MONOMER EXCITATION ON THE TUNNELING SPLITTING OF THE HYDROGEN-FLUORIDE DIMER
122
#LCRNCRNode / Date / Journal / AuthorLCSGCS
1109193523595 1990 JOURNAL OF CHEMICAL PHYSICS 92 (10): 5988-5996
QIAN K; SHUKLA A; FUTRELL J
COLLISION-INDUCED INTRAMOLECULAR ENERGY-TRANSFER AND DISSOCIATION OF ACETONE MOLECULAR ION
634
1109242425926 1995 JOURNAL OF CHEMICAL PHYSICS 103 (12): 4869-4878
KATO H; DOI A; TAROURA Y; NAGAKURA S
EFFECTS OF MAGNETIC-FIELD ON THE 15V 31,344.9 BAND OF CS2 STUDIED BY SUB-DOPPLER HIGH-RESOLUTION SPECTROSCOPY
18
1109384527084 1998 JOURNAL OF CHEMICAL PHYSICS 109 (3): 942-950
Bominaar EL; Achim C; Peterson J
Theory for magnetic linear dichroism of electronic transitions between twofold-degenerate molecular spin levels
13
1109442227443 1999 JOURNAL OF CHEMICAL PHYSICS 110 (10): 4724-4729
Kato H; Taroura Y; Kasahara S; Baba M
M-resolved Zeeman spectra of rotational lines in the 9U band of CS2, and splittings of the (3)A(2)((3)Delta(u)) state
02
1109547828066 2001 JOURNAL OF CHEMICAL PHYSICS 114 (24): 10757-10767
Nguyen KA; Pachter R
Ground state electronic structures and spectra of zinc complexes of porphyrin, tetraazaporphyrin, tetrabenzoporphyrin, and phthalocyanine: A density functional theory study
544
1109645528345 2002 JOURNAL OF CHEMICAL PHYSICS 116 (9): 3554-3567
Card DA; Wisniewski ES; Folmer DE; Castleman AW
Dynamics of Coulomb explosion and kinetic energy release in clusters of heterocyclic compounds
119
1109776528346 2002 JOURNAL OF CHEMICAL PHYSICS 116 (16): 6930-6940
Autschbach J; Ziegler T; van Gisbergen SJA; Baerends EJ
Chiroptical properties from time-dependent density functional theory. I. Circular dichroism spectra of organic molecules
425
1109864928347 2002 JOURNAL OF CHEMICAL PHYSICS 117 (2): 581-592
Autschbach J; Patchkovskii S; Ziegler T; van Gisbergen SJA; Baerends EJ
Chiroptical properties from time-dependent density functional theory. II. Optical rotations of small to medium sized organic molecules
623
1109924428348 2002 JOURNAL OF CHEMICAL PHYSICS 117 (24): 11196-11207
Miyahara T; Nakatsuji H; Hasegawa J; Osuka A; Aratani N; et al.
Ground and excited states of linked and fused zinc porphyrin dimers: Symmetry adapted cluster (SAC)-configuration interaction (CI) study
04
1110025528622 2003 JOURNAL OF CHEMICAL PHYSICS 119 (4): 1978-1985
Di Stefano M; Rosi M; Sgamellotti A; Ascenzi D; Bassi D; et al.
Experimental and theoretical investigation of the production of cations containing C-N bonds in the reaction of benzene with atomic nitrogen ions
15

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