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Results:
1-17
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Results: 17
Authors:
CHIPOT C
POHORILLE A
Citation: C. Chipot et A. Pohorille, CONFORMATIONAL EQUILIBRIA OF TERMINALLY BLOCKED SINGLE AMINO-ACIDS ATTHE WATER-HEXANE INTERFACE - A MOLECULAR-DYNAMICS STUDY, JOURNAL OF PHYSICAL CHEMISTRY B, 102(1), 1998, pp. 281-290
Authors:
CHIPOT C
ANGYAN JG
MILLOT C
Citation: C. Chipot et al., STATISTICAL-ANALYSIS OF DISTRIBUTED MULTIPOLES DERIVED FROM MOLECULARELECTROSTATIC POTENTIALS, Molecular physics, 94(6), 1998, pp. 881-895
Authors:
CHIPOT C
POHORILLE A
Citation: C. Chipot et A. Pohorille, FOLDING AND TRANSLOCATION OF THE UNDECAMER OF POLY-L-LEUCINE ACROSS THE WATER-HEXANE INTERFACE - A MOLECULAR-DYNAMICS STUDY, Journal of the American Chemical Society, 120(46), 1998, pp. 11912-11924
Authors:
SOETENS JC
MILLOT C
CHIPOT C
JANSEN G
ANGYAN JG
MAIGRET B
Citation: Jc. Soetens et al., EFFECT OF POLARIZABILITY ON THE POTENTIAL OF MEAN FORCE OF 2 CATIONS - THE GUANIDINIUM-GUANIDINIUM ION-PAIR IN WATER, JOURNAL OF PHYSICAL CHEMISTRY B, 101(50), 1997, pp. 10910-10917
Authors:
CHIPOT C
WILSON MA
POHORILLE A
Citation: C. Chipot et al., INTERACTIONS OF ANESTHETICS WITH THE WATER-HEXANE INTERFACE - A MOLECULAR-DYNAMICS STUDY, JOURNAL OF PHYSICAL CHEMISTRY B, 101(5), 1997, pp. 782-791
Authors:
CHIPOT C
POHORILLE A
Citation: C. Chipot et A. Pohorille, STRUCTURE AND DYNAMICS OF SMALL PEPTIDES AT AQUEOUS INTERFACES - A MULTI-NANOSECOND MOLECULAR-DYNAMICS STUDY, Journal of molecular structure. Theochem, 398, 1997, pp. 529-535
Authors:
POHORILLE A
WILSON MA
CHIPOT C
Citation: A. Pohorille et al., INTERACTIONS OF SMALL SOLUTES WITH MEMBRANES, Biophysical journal, 70(2), 1996, p.
Authors:
CHIPOT C
JAFFE R
MAIGRET B
PEARLMAN DA
KOLLMAN PA
Citation: C. Chipot et al., BENZENE DIMER - A GOOD MODEL FOR PI-PI INTERACTIONS IN PROTEINS - A COMPARISON BETWEEN THE BENZENE AND THE TOLUENE DIMERS IN THE CAS PHASE AND IN AN AQUEOUS-SOLUTION, Journal of the American Chemical Society, 118(45), 1996, pp. 11217-11224
Authors:
CHIPOT C
MAIGRET B
PEARLMAN DA
KOLLMAN PA
Citation: C. Chipot et al., MOLECULAR-DYNAMICS POTENTIAL OF MEAN FORCE CALCULATIONS - A STUDY OF THE TOLUENE-AMMONIUM PI-CATION INTERACTIONS, Journal of the American Chemical Society, 118(12), 1996, pp. 2998-3005
Authors:
CHIPOT C
GORB LG
RIVAIL JL
Citation: C. Chipot et al., PROTON-TRANSFER IN THE MONOHYDRATED AND THE DIHYDRATED COMPLEXES OF HF AND HCL - AN MP2 6-31+G(ASTERISK-ASTERISK) AB-INITIO STUDY IN THE SELF-CONSISTENT REACTION FIELD MODEL OF SOLVATION/, Journal of physical chemistry, 98(6), 1994, pp. 1601-1607
Authors:
CHIPOT C
ANGYAN JG
MAIGRET A
SCHERAGA HA
Citation: C. Chipot et al., MODELING AMINO-ACID SIDE-CHAINS .3. INFLUENCE OF INTRAMOLECULAR AND INTERMOLECULAR ENVIRONMENT ON POINT CHARGES (VOL 97, PG 9799, 1993), Journal of physical chemistry, 98(5), 1994, pp. 1518-1518
Authors:
CHIPOT C
MILLOT C
MAIGRET B
KOLLMAN PA
Citation: C. Chipot et al., MOLECULAR-DYNAMICS FREE-ENERGY PERTURBATION CALCULATIONS - INFLUENCE OF NONBONDED PARAMETERS ON THE FREE-ENERGY OF HYDRATION OF CHARGED ANDNEUTRAL SPECIES, Journal of physical chemistry, 98(44), 1994, pp. 11362-11372
Authors:
CHIPOT C
MILLOT C
MAIGRET B
KOLLMAN PA
Citation: C. Chipot et al., MOLECULAR-DYNAMICS FREE-ENERGY SIMULATIONS - INFLUENCE OF THE TRUNCATION OF LONG-RANGE NONBONDED ELECTROSTATIC INTERACTIONS ON FREE-ENERGY CALCULATIONS OF POLAR-MOLECULES, The Journal of chemical physics, 101(9), 1994, pp. 7953-7962
Authors:
ANGYAN JG
CHIPOT C
Citation: Jg. Angyan et C. Chipot, A COMPREHENSIVE APPROACH TO MOLECULAR CHARGE-DENSITY MODELS - FROM DISTRIBUTED MULTIPOLES TO FITTED ATOMIC CHARGES, International journal of quantum chemistry, 52(1), 1994, pp. 17-37
Authors:
CHIPOT C
ANGYAN JG
MAIGRET B
SCHERAGA HA
Citation: C. Chipot et al., MODELING AMINO-ACID SIDE-CHAINS .2. DETERMINATION OF POINT CHARGES FROM ELECTROSTATIC PROPERTIES - TOWARD TRANSFERABLE POINT-CHARGE MODELS, Journal of physical chemistry, 97(38), 1993, pp. 9788-9796
Authors:
CHIPOT C
ANGYAN JG
MAIGRET B
SCHERAGA HA
Citation: C. Chipot et al., MODELING AMINO-ACID SIDE-CHAINS .3. INFLUENCE OF INTRAMOLECULAR AND INTERMOLECULAR ENVIRONMENT ON POINT CHARGES, Journal of physical chemistry, 97(38), 1993, pp. 9797-9807
Authors:
CHIPOT C
ANGYAN JG
FERENCZY GG
SCHERAGA HA
Citation: C. Chipot et al., TRANSFERABLE NET ATOMIC CHARGES FROM A DISTRIBUTED MULTIPOLE ANALYSISFOR THE DESCRIPTION OF ELECTROSTATIC PROPERTIES - A CASE-STUDY OF SATURATED-HYDROCARBONS, Journal of physical chemistry, 97(25), 1993, pp. 6628-6636
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