AAAAAA

   
Results: 1-25 | 26-50 | 51-68
Results: 1-25/68
STRUCTURE, REACTION ENTHALPIES, ENTROPIES, AND FREE-ENERGIES OF CATION-MOLECULE COMPLEXES - A THEORETICAL-STUDY BY MEANS OF THE AB-INITIO COMPLETE BASIS-SET CBS-Q METHOD
Authors: REMKO M LIEDL KR RODE BM
Citation: M. Remko et al., STRUCTURE, REACTION ENTHALPIES, ENTROPIES, AND FREE-ENERGIES OF CATION-MOLECULE COMPLEXES - A THEORETICAL-STUDY BY MEANS OF THE AB-INITIO COMPLETE BASIS-SET CBS-Q METHOD, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(4), 1998, pp. 771-777
MONTE-CARLO SIMULATIONS AND NEUTRON-DIFFRACTION STUDIES OF THE PEPTIDE FORMING SYSTEM 0.5 MOL KG(-1) CUCL2-5 MOL KG(-1) NACL-H2O AT 293 AND353 K
Authors: TEXLER NR HOLDWAY S NEILSON GW RODE BM
Citation: Nr. Texler et al., MONTE-CARLO SIMULATIONS AND NEUTRON-DIFFRACTION STUDIES OF THE PEPTIDE FORMING SYSTEM 0.5 MOL KG(-1) CUCL2-5 MOL KG(-1) NACL-H2O AT 293 AND353 K, Journal of the Chemical Society. Faraday transactions, 94(1), 1998, pp. 59-65
COMPARATIVE MOLECULAR-FIELD ANALYSIS OF ARTEMISININ DERIVATIVES - AB-INITIO VERSUS SEMIEMPIRICAL OPTIMIZED STRUCTURES
Authors: TONMUNPHEAN S KOKPOL S PARASUK V WOLSCHANN P WINGER RH LIEDL KR RODE BM
Citation: S. Tonmunphean et al., COMPARATIVE MOLECULAR-FIELD ANALYSIS OF ARTEMISININ DERIVATIVES - AB-INITIO VERSUS SEMIEMPIRICAL OPTIMIZED STRUCTURES, Journal of computer-aided molecular design, 12(4), 1998, pp. 397-409
CATALYSIS OF DIALANINE FORMATION BY GLYCINE IN THE SALT-INDUCED PEPTIDE FORMATION REACTION
Authors: SUWANNACHOT Y RODE BM
Citation: Y. Suwannachot et Bm. Rode, CATALYSIS OF DIALANINE FORMATION BY GLYCINE IN THE SALT-INDUCED PEPTIDE FORMATION REACTION, Origins of life and evolution of the biosphere, 28(1), 1998, pp. 79-90
LIGAND-INDUCED DOMAIN MOVEMENT IN AN ANTIBODY FAB - MOLECULAR-DYNAMICS STUDIES CONFIRM THE UNIQUE DOMAIN MOVEMENT OBSERVED EXPERIMENTALLY FOR FAB NC6.8 UPON COMPLEXATION AND REVEAL ITS SEGMENTAL FLEXIBILITY
Authors: SOTRIFFER CA LIEDL KR LINTHICUM DS RODE BM VARGA JM
Citation: Ca. Sotriffer et al., LIGAND-INDUCED DOMAIN MOVEMENT IN AN ANTIBODY FAB - MOLECULAR-DYNAMICS STUDIES CONFIRM THE UNIQUE DOMAIN MOVEMENT OBSERVED EXPERIMENTALLY FOR FAB NC6.8 UPON COMPLEXATION AND REVEAL ITS SEGMENTAL FLEXIBILITY, Journal of Molecular Biology, 278(2), 1998, pp. 301-306
PREDICTIONS OF RATE CONSTANTS AND ESTIMATES FOR TUNNELING SPLITTINGS OF CONCERTED PROTON-TRANSFER IN SMALL CYCLIC WATER CLUSTERS
Authors: LOERTING T LIEDL KR RODE BM
Citation: T. Loerting et al., PREDICTIONS OF RATE CONSTANTS AND ESTIMATES FOR TUNNELING SPLITTINGS OF CONCERTED PROTON-TRANSFER IN SMALL CYCLIC WATER CLUSTERS, The Journal of chemical physics, 109(7), 1998, pp. 2672-2679
SALT-INDUCED PEPTIDE FORMATION FROM AMINO-ACIDS IN THE PRESENCE OF CLAYS AND RELATED CATALYSTS
Authors: LESON H SUWANNACHOT Y BUJDAK J RODE BM
Citation: H. Leson et al., SALT-INDUCED PEPTIDE FORMATION FROM AMINO-ACIDS IN THE PRESENCE OF CLAYS AND RELATED CATALYSTS, Inorganica Chimica Acta, 272(1-2), 1998, pp. 89-94
THE HYDRATION SHELL STRUCTURE OF LI-OPPENHEIMER AB-INITIO QM( INVESTIGATED BY BORN)MM DYNAMICS/
Authors: TONGRAAR A LIEDL KR RODE BM
Citation: A. Tongraar et al., THE HYDRATION SHELL STRUCTURE OF LI-OPPENHEIMER AB-INITIO QM( INVESTIGATED BY BORN)MM DYNAMICS/, Chemical physics letters, 286(1-2), 1998, pp. 56-64
SOLVATION OF CA2-OPPENHEIMER AB-INITIO QM( IN WATER STUDIED BY BORN)MM DYNAMICS/
Authors: TONGRAAR A LIEDL KR RODE BM
Citation: A. Tongraar et al., SOLVATION OF CA2-OPPENHEIMER AB-INITIO QM( IN WATER STUDIED BY BORN)MM DYNAMICS/, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(35), 1997, pp. 6299-6309
NEW INSIGHTS INTO THE DYNAMICS OF CONCERTED PROTON TUNNELING IN CYCLIC WATER AND HYDROGEN-FLUORIDE CLUSTERS
Authors: LIEDL KR SEKUSAK S KROEMER RT RODE BM
Citation: Kr. Liedl et al., NEW INSIGHTS INTO THE DYNAMICS OF CONCERTED PROTON TUNNELING IN CYCLIC WATER AND HYDROGEN-FLUORIDE CLUSTERS, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(26), 1997, pp. 4707-4716
REACTION-PATH DYNAMICS OF HYDROXYL RADICAL REACTIONS WITH ETHANE AND HALOETHANES
Authors: SEKUSAK S LIEDL KR RODE BM SABLJIC A
Citation: S. Sekusak et al., REACTION-PATH DYNAMICS OF HYDROXYL RADICAL REACTIONS WITH ETHANE AND HALOETHANES, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(23), 1997, pp. 4245-4253
THEORETICAL-STUDY ON THE LOCAL ANESTHETIC-RECEPTOR INTERACTION
Authors: REMKO M LIEDL KR RODE BM
Citation: M. Remko et al., THEORETICAL-STUDY ON THE LOCAL ANESTHETIC-RECEPTOR INTERACTION, Chemicke zvesti, 51(4), 1997, pp. 234-241
MONTE-CARLO SIMULATIONS OF COPPER CHLORIDE SOLUTIONS AT VARIOUS CONCENTRATIONS INCLUDING FULL 3-BODY CORRECTION TERMS
Authors: TEXLER NR RODE BM
Citation: Nr. Texler et Bm. Rode, MONTE-CARLO SIMULATIONS OF COPPER CHLORIDE SOLUTIONS AT VARIOUS CONCENTRATIONS INCLUDING FULL 3-BODY CORRECTION TERMS, Chemical physics, 222(2-3), 1997, pp. 281-288
MOLECULAR-DYNAMICS SIMULATIONS OF NA- IONS SOLVATION IN AQUEOUS MIXTURES OF FORMAMIDE( AND CL)
Authors: PUHOVSKI YP RODE BM
Citation: Yp. Puhovski et Bm. Rode, MOLECULAR-DYNAMICS SIMULATIONS OF NA- IONS SOLVATION IN AQUEOUS MIXTURES OF FORMAMIDE( AND CL), Chemical physics, 222(1), 1997, pp. 43-57
MOLECULAR-DYNAMICS SIMULATIONS OF A POTASSIUM-ION AND AN IODIDE-ION IN LIQUID-AMMONIA
Authors: TONGRAAR A HANNONGBUA S RODE BM
Citation: A. Tongraar et al., MOLECULAR-DYNAMICS SIMULATIONS OF A POTASSIUM-ION AND AN IODIDE-ION IN LIQUID-AMMONIA, Chemical physics, 219(2-3), 1997, pp. 279-290
HOW ACIDIC ARE THIOCARBOXYLIC S-ACIDS AND THIOSILANOIC S-ACIDS (X-YOSH, X = H, F, CL, CH3, NH2, Y = C, SI)
Authors: REMKO M LIEDL KR RODE BM
Citation: M. Remko et al., HOW ACIDIC ARE THIOCARBOXYLIC S-ACIDS AND THIOSILANOIC S-ACIDS (X-YOSH, X = H, F, CL, CH3, NH2, Y = C, SI), Journal of molecular structure. Theochem, 418(2-3), 1997, pp. 179-187
GLYCINE OLIGOMERIZATION ON SILICA AND ALUMINA
Authors: BUJDAK J RODE BM
Citation: J. Bujdak et Bm. Rode, GLYCINE OLIGOMERIZATION ON SILICA AND ALUMINA, Reaction kinetics and catalysis letters, 62(2), 1997, pp. 281-286
SILICA, ALUMINA, AND CLAY-CATALYZED ALANINE PEPTIDE-BOND FORMATION
Authors: BUJDAK J RODE BM
Citation: J. Bujdak et Bm. Rode, SILICA, ALUMINA, AND CLAY-CATALYZED ALANINE PEPTIDE-BOND FORMATION, Journal of molecular evolution, 45(5), 1997, pp. 457-466
COMPARATIVE MOLECULAR-FIELD ANALYSIS OF HAPTENS DOCKED TO THE MULTISPECIFIC ANTIBODY IGE(LB4) (VOL 39, PG 3885, 1996)
Authors: GAMPER AM WINGER RH LIEDL KR SOTRIFFER CA VARGA JM KROEMER RT RODE BM
Citation: Am. Gamper et al., COMPARATIVE MOLECULAR-FIELD ANALYSIS OF HAPTENS DOCKED TO THE MULTISPECIFIC ANTIBODY IGE(LB4) (VOL 39, PG 3885, 1996), Journal of medicinal chemistry, 40(6), 1997, pp. 1047-1048
SOLVATED ION DYNAMICS IN THE WATER-FORMAMIDE MIXTURES USING MOLECULAR-DYNAMICS SIMULATIONS
Authors: PUHOVSKI YP RODE BM
Citation: Yp. Puhovski et Bm. Rode, SOLVATED ION DYNAMICS IN THE WATER-FORMAMIDE MIXTURES USING MOLECULAR-DYNAMICS SIMULATIONS, The Journal of chemical physics, 107(17), 1997, pp. 6908-6916
AMINO-ACID-SEQUENCE PREFERENCES OF THE SALT-INDUCED PEPTIDE FORMATIONREACTION IN COMPARISON TO ARCHAIC CELL PROTEIN-COMPOSITION
Authors: RODE BM EDER AH YONGYAI Y
Citation: Bm. Rode et al., AMINO-ACID-SEQUENCE PREFERENCES OF THE SALT-INDUCED PEPTIDE FORMATIONREACTION IN COMPARISON TO ARCHAIC CELL PROTEIN-COMPOSITION, Inorganica Chimica Acta, 254(2), 1997, pp. 309-314
MOLECULAR MODELING OF POLYMERS .3. PREDICTION OF GLASS-TRANSITION TEMPERATURES OF POLY(ACRYLIC ACID), POLY(METHACRYLIC ACID) AND POLYACRYLAMIDE DERIVATIVES
Authors: TAN TTM RODE BM
Citation: Ttm. Tan et Bm. Rode, MOLECULAR MODELING OF POLYMERS .3. PREDICTION OF GLASS-TRANSITION TEMPERATURES OF POLY(ACRYLIC ACID), POLY(METHACRYLIC ACID) AND POLYACRYLAMIDE DERIVATIVES, Macromolecular theory and simulations, 5(3), 1996, pp. 467-475
THE EFFECT OF REACTION CONDITIONS ON MONTMORILLONITE-CATALYZED PEPTIDE FORMATION
Authors: BUJDAK J LESON H YONGYAI Y RODE BM
Citation: J. Bujdak et al., THE EFFECT OF REACTION CONDITIONS ON MONTMORILLONITE-CATALYZED PEPTIDE FORMATION, Catalysis letters, 37(3-4), 1996, pp. 267-272
COMPARATIVE MOLECULAR-FIELD ANALYSIS OF HIV-1 REVERSE-TRANSCRIPTASE INHIBITORS IN THE CLASS OF 1[(2-HYDROXYETHOXY)-METHYL]-6(PHENYLTHIO)THYMINE
Authors: HANNONGBUA S LAWTRAKUL L SOTRIFFER CA RODE BM
Citation: S. Hannongbua et al., COMPARATIVE MOLECULAR-FIELD ANALYSIS OF HIV-1 REVERSE-TRANSCRIPTASE INHIBITORS IN THE CLASS OF 1[(2-HYDROXYETHOXY)-METHYL]-6(PHENYLTHIO)THYMINE, Quantitative structure-activity relationships, 15(5), 1996, pp. 389-394
COMPARATIVE DOCKING STUDIES ON LIGAND-BINDING TO THE MULTISPECIFIC ANTIBODIES IGE-LA2 AND IGE-LB4
Authors: SOTRIFFER CA WINGER RH LIEDL KR RODE BM VARGA JM
Citation: Ca. Sotriffer et al., COMPARATIVE DOCKING STUDIES ON LIGAND-BINDING TO THE MULTISPECIFIC ANTIBODIES IGE-LA2 AND IGE-LB4, Journal of computer-aided molecular design, 10(4), 1996, pp. 305-320
Risultati: 1-25 | 26-50 | 51-68