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Results: 1-7 |
Results: 7
ALTERNATIVE SCHEMES FOR THE INCLUSION OF A REACTION-FIELD CORRECTION INTO MOLECULAR-DYNAMICS SIMULATIONS - INFLUENCE ON THE SIMULATED ENERGETIC, STRUCTURAL, AND DIELECTRIC-PROPERTIES OF LIQUID WATER
Authors: HUNENBERGER PH VANGUNSTEREN WF
Citation: Ph. Hunenberger et Wf. Vangunsteren, ALTERNATIVE SCHEMES FOR THE INCLUSION OF A REACTION-FIELD CORRECTION INTO MOLECULAR-DYNAMICS SIMULATIONS - INFLUENCE ON THE SIMULATED ENERGETIC, STRUCTURAL, AND DIELECTRIC-PROPERTIES OF LIQUID WATER, The Journal of chemical physics, 108(15), 1998, pp. 6117-6134
EXPERIMENTAL AND THEORETICAL APPROACH TO HYDROGEN-BONDED DIASTEREOMERIC INTERACTIONS IN A MODEL COMPLEX
Authors: HUNENBERGER PH GRANWEHR JK AEBISCHER JN GHONEIM N HASELBACH E VANGUNSTEREN WF
Citation: Ph. Hunenberger et al., EXPERIMENTAL AND THEORETICAL APPROACH TO HYDROGEN-BONDED DIASTEREOMERIC INTERACTIONS IN A MODEL COMPLEX, Journal of the American Chemical Society, 119(32), 1997, pp. 7533-7544
FREE-ENERGIES OF TRANSFER OF TRP ANALOGS FROM CHLOROFORM TO WATER - COMPARISON OF THEORY AND EXPERIMENT AND THE IMPORTANCE OF ADEQUATE TREATMENT OF ELECTROSTATIC AND INTERNAL INTERACTIONS
Authors: DAURA X HUNENBERGER PH MARK AE QUEROL E AVILES FX VANGUNSTEREN WF
Citation: X. Daura et al., FREE-ENERGIES OF TRANSFER OF TRP ANALOGS FROM CHLOROFORM TO WATER - COMPARISON OF THEORY AND EXPERIMENT AND THE IMPORTANCE OF ADEQUATE TREATMENT OF ELECTROSTATIC AND INTERNAL INTERACTIONS, Journal of the American Chemical Society, 118(26), 1996, pp. 6285-6294
INVESTIGATION OF PROTEIN UNFOLDING AND STABILITY BY COMPUTER-SIMULATION
Authors: VANGUNSTEREN WF HUNENBERGER PH KOVACS H MARK AE SCHIFFER CA
Citation: Wf. Vangunsteren et al., INVESTIGATION OF PROTEIN UNFOLDING AND STABILITY BY COMPUTER-SIMULATION, Philosophical transactions-Royal Society of London. Biological sciences, 348(1323), 1995, pp. 49-59
COMPUTATIONAL APPROACHES TO STUDY PROTEIN UNFOLDING - HEN EGG-WHITE LYSOZYME AS A CASE-STUDY
Authors: HUNENBERGER PH MARK AE VANGUNSTEREN WF
Citation: Ph. Hunenberger et al., COMPUTATIONAL APPROACHES TO STUDY PROTEIN UNFOLDING - HEN EGG-WHITE LYSOZYME AS A CASE-STUDY, Proteins, 21(3), 1995, pp. 196-213
FLUCTUATION AND CROSS-CORRELATION ANALYSIS OF PROTEIN MOTIONS OBSERVED IN NANOSECOND MOLECULAR-DYNAMICS SIMULATIONS
Authors: HUNENBERGER PH MARK AE VANGUNSTEREN WF
Citation: Ph. Hunenberger et al., FLUCTUATION AND CROSS-CORRELATION ANALYSIS OF PROTEIN MOTIONS OBSERVED IN NANOSECOND MOLECULAR-DYNAMICS SIMULATIONS, Journal of Molecular Biology, 252(4), 1995, pp. 492-503
COMPUTER-SIMULATION OF PROTEIN MOTION
Authors: VANGUNSTEREN WF HUNENBERGER PH MARK AE SMITH PE TIRONI IG
Citation: Wf. Vangunsteren et al., COMPUTER-SIMULATION OF PROTEIN MOTION, Computer physics communications, 91(1-3), 1995, pp. 305-319
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