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Results:
1-20
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Results: 20
Authors:
MAVRI J
HADZI D
Citation: J. Mavri et D. Hadzi, INFLUENCE OF SOLVATION ON THE HYDROGEN-BOND IN HYDROGEN MALONATE - ANAB-INITIO AND SEMIEMPIRICAL STUDY, Journal of molecular structure. Theochem, 432(3), 1998, pp. 257-262
Authors:
MAVRI J
Citation: J. Mavri, IRREVERSIBLE INHIBITION OF THE HIV-1 PROTEASE - A THEORETICAL-STUDY, International journal of quantum chemistry, 69(6), 1998, pp. 753-759
Authors:
FEDOROWICZ A
MAVRI J
BALA P
KOLL A
Citation: A. Fedorowicz et al., MOLECULAR-DYNAMICS STUDY OF THE TAUTOMERIC EQUILIBRIUM IN THE MANNICHBASE, Chemical physics letters, 289(5-6), 1998, pp. 457-462
Authors:
MAVRI J
KOLLER J
HADZI D
Citation: J. Mavri et al., CALCULATIONS BY THE SEMI-AB INITIO METHOD SAM1 ON SOME HYDROGEN-BONDED SYSTEMS, Journal of molecular structure, 416(1-3), 1997, pp. 261-268
Authors:
MAVRI J
VOGEL HJ
Citation: J. Mavri et Hj. Vogel, ION-PAIR FORMATION OF PHOSPHORYLATED AMINO-ACIDS AND LYSINE AND ARGININE SIDE-CHAINS - A THEORETICAL-STUDY, Proteins, 24(4), 1996, pp. 495-501
Authors:
LENSINK MF
MAVRI J
BERENDSEN HJC
Citation: Mf. Lensink et al., SIMULTANEOUS INTEGRATION OF MIXED QUANTUM-CLASSICAL SYSTEMS BY DENSITY-MATRIX EVOLUTION-EQUATIONS USING INTERACTION REPRESENTATION AND ADAPTIVE TIME-STEP INTEGRATOR, Journal of computational chemistry, 17(11), 1996, pp. 1287-1295
Authors:
LENDERINK E
DUPPEN K
EVERDIJ FPX
MAVRI J
TORRE R
WIERSMA DA
Citation: E. Lenderink et al., PHOTODISSOCIATION DYNAMICS OF THE IODINE-ARENE CHARGE-TRANSFER COMPLEX, Journal of physical chemistry, 100(19), 1996, pp. 7822-7831
Authors:
BERENDSEN HJC
MAVRI J
Citation: Hjc. Berendsen et J. Mavri, APPROACH TO NONADIABATIC TRANSITIONS BY DENSITY-MATRIX EVOLUTION AND MOLECULAR-DYNAMICS SIMULATIONS, International journal of quantum chemistry, 57(5), 1996, pp. 975-983
Authors:
MAVRI J
BERENDSEN HJC
Citation: J. Mavri et Hjc. Berendsen, CALCULATION OF THE PROTON-TRANSFER RATE USING DENSITY-MATRIX EVOLUTION AND MOLECULAR-DYNAMICS SIMULATIONS - INCLUSION OF THE PROTON EXCITED-STATES, Journal of physical chemistry, 99(34), 1995, pp. 12711-12717
Authors:
MEDEN A
MAVRI J
BELE M
PEJOVNIK S
Citation: A. Meden et al., DISSOLUTION OF BORON IN LITHIUM MELT, Journal of physical chemistry, 99(12), 1995, pp. 4252-4260
Authors:
JORDAN PC
VANMAAREN PJ
MAVRI J
VANDERSPOEL D
BERENDSEN HJC
Citation: Pc. Jordan et al., TOWARDS PHASE TRANSFERABLE POTENTIAL FUNCTIONS - METHODOLOGY AND APPLICATION TO NITROGEN, The Journal of chemical physics, 103(6), 1995, pp. 2272-2285
Authors:
MAVRI J
BERENDSEN HJC
Citation: J. Mavri et Hjc. Berendsen, DYNAMICAL SIMULATION OF A QUANTUM HARMONIC-OSCILLATOR IN A NOBLE-GAS BATH BY DENSITY-MATRIX EVOLUTION, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics, 50(1), 1994, pp. 198-204
Authors:
MAVRI J
VOGEL HJ
Citation: J. Mavri et Hj. Vogel, ION-PAIR FORMATION INVOLVING METHYLATED LYSINE SIDE-CHAINS - A THEORETICAL-STUDY, Proteins, 18(4), 1994, pp. 381-389
Authors:
MAVRI J
LENSINK M
BERENDSEN HJC
Citation: J. Mavri et al., TREATMENT OF INELASTIC-COLLISIONS OF A PARTICLE WITH A QUANTUM HARMONIC-OSCILLATOR BY DENSITY-MATRIX EVOLUTION, Molecular physics, 82(6), 1994, pp. 1249-1257
Authors:
MAVRI J
BERENDSEN HJC
Citation: J. Mavri et Hjc. Berendsen, TREATMENT OF NONADIABATIC TRANSITIONS BY DENSITY-MATRIX EVOLUTION ANDMOLECULAR-DYNAMICS SIMULATIONS, Journal of molecular structure, 322, 1994, pp. 1-7
Authors:
MAVRI J
KOLLER J
HADZI D
Citation: J. Mavri et al., AB-INITIO AND AM1 CALCULATIONS ON MODEL SYSTEMS OF ACETYLCHOLINE BINDING - COMPLEXES OF TETRAMETHYLAMMONIUM WITH AROMATICS, NEUTRAL AND IONIC FORMIC-ACID (VOL 283, PG 305, 1993), Journal of molecular structure. Theochem, 104(3), 1993, pp. 297-297
Authors:
MAVRI J
KOLLER J
HADZI D
Citation: J. Mavri et al., AB-INITIO AND AM1 CALCULATIONS ON MODEL SYSTEMS OF ACETYLCHOLINE BINDING - COMPLEXES OF TETRAMETHYLAMMONIUM WITH AROMATICS, NEUTRAL AND IONIC FORMIC-ACID, Journal of molecular structure. Theochem, 102, 1993, pp. 305-312
Authors:
BERENDSEN HJC
MAVRI J
Citation: Hjc. Berendsen et J. Mavri, QUANTUM SIMULATION OF REACTION DYNAMICS BY DENSITY-MATRIX EVOLUTION, Journal of physical chemistry, 97(51), 1993, pp. 13464-13468
Authors:
MAVRI J
BERENDSEN HJC
VANGUNSTEREN WF
Citation: J. Mavri et al., INFLUENCE OF SOLVENT ON INTRAMOLECULAR PROTON-TRANSFER IN HYDROGEN MALONATE - MOLECULAR-DYNAMICS SIMULATION STUDY OF TUNNELING BY DENSITY-MATRIX EVOLUTION AND NONEQUILIBRIUM SOLVATION, Journal of physical chemistry, 97(51), 1993, pp. 13469-13476
Authors:
PRISTOVSEK P
KIDRIC J
MAVRI J
HADZI D
Citation: P. Pristovsek et al., NMR AND MOLECULAR-DYNAMICS STUDY OF 4 CARBOCYCLIC MURAMYL DIPEPTIDE ANALOGS, Biopolymers, 33(7), 1993, pp. 1149-1157
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