AAAAAA

   
Results: 1-25 |
Results: 25
EXPERIMENTALLY TESTING COMPUTATIONAL MODELS FOR IONIZATION EQUILIBRIAIN TURKEY OVOMUCOID 3RD DOMAIN
Authors: FORSYTH WR GILSON MK ANTOSIEWICZ J JAREM OR ROBERTSON AD
Citation: Wr. Forsyth et al., EXPERIMENTALLY TESTING COMPUTATIONAL MODELS FOR IONIZATION EQUILIBRIAIN TURKEY OVOMUCOID 3RD DOMAIN, Biophysical journal, 74(2), 1998, pp. 369-369
THEORETICAL AND EXPERIMENTAL-ANALYSIS OF IONIZATION EQUILIBRIA IN OVOMUCOID 3RD DOMAIN
Authors: FORSYTH WR GILSON MK ANTOSIEWICZ J JAREN OR ROBERTSON AD
Citation: Wr. Forsyth et al., THEORETICAL AND EXPERIMENTAL-ANALYSIS OF IONIZATION EQUILIBRIA IN OVOMUCOID 3RD DOMAIN, Biochemistry, 37(24), 1998, pp. 8643-8652
PK(A) SHIFTS IN SMALL MOLECULES AND HIV PROTEASE - ELECTROSTATICS ANDCONFORMATION
Authors: LUO R HEAD MS MOULT J GILSON MK
Citation: R. Luo et al., PK(A) SHIFTS IN SMALL MOLECULES AND HIV PROTEASE - ELECTROSTATICS ANDCONFORMATION, Journal of the American Chemical Society, 120(24), 1998, pp. 6138-6146
DIELECTRIC SCREENING TREATMENT OF ELECTROSTATIC SOLVATION
Authors: LUO R MOULT J GILSON MK
Citation: R. Luo et al., DIELECTRIC SCREENING TREATMENT OF ELECTROSTATIC SOLVATION, JOURNAL OF PHYSICAL CHEMISTRY B, 101(51), 1997, pp. 11226-11236
MINING MINIMA - DIRECT COMPUTATION OF CONFORMATIONAL FREE-ENERGY
Authors: HEAD MS GIVEN JA GILSON MK
Citation: Ms. Head et al., MINING MINIMA - DIRECT COMPUTATION OF CONFORMATIONAL FREE-ENERGY, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(8), 1997, pp. 1609-1618
A NEW CLASS OF MODELS FOR COMPUTING RECEPTOR-LIGAND BINDING AFFINITIES
Authors: GILSON MK GIVEN JA HEAD MS
Citation: Mk. Gilson et al., A NEW CLASS OF MODELS FOR COMPUTING RECEPTOR-LIGAND BINDING AFFINITIES, Chemistry & biology, 4(2), 1997, pp. 87-92
RESPONSIBILITY OF CO-AUTHORS
Authors: GILSON MK
Citation: Mk. Gilson, RESPONSIBILITY OF CO-AUTHORS, Science, 275(5296), 1997, pp. 14-14
THE STATISTICAL-THERMODYNAMIC BASIS FOR COMPUTATION OF BINDING AFFINITIES - A CRITICAL-REVIEW
Authors: GILSON MK GIVEN JA BUSH BL MCCAMMON JA
Citation: Mk. Gilson et al., THE STATISTICAL-THERMODYNAMIC BASIS FOR COMPUTATION OF BINDING AFFINITIES - A CRITICAL-REVIEW, Biophysical journal, 72(3), 1997, pp. 1047-1069
MINING MINIMA - DIRECT COMPUTATION OF CONFORMATIONAL FREE-ENERGY
Authors: HEAD MS GIVEN JA GILSON MK
Citation: Ms. Head et al., MINING MINIMA - DIRECT COMPUTATION OF CONFORMATIONAL FREE-ENERGY, Biophysical journal, 72(2), 1997, pp. 437-437
COMPUTING IONIZATION STATES OF PROTEINS WITH A DETAILED CHARGE MODEL
Authors: ANTOSIEWICZ J BRIGGS JM ELCOCK AH GILSON MK MCCAMMON JA
Citation: J. Antosiewicz et al., COMPUTING IONIZATION STATES OF PROTEINS WITH A DETAILED CHARGE MODEL, Journal of computational chemistry, 17(14), 1996, pp. 1633-1644
COMPARISON OF CONTINUUM AND EXPLICIT MODELS OF SOLVATION - POTENTIALSOF MEAN FORCE FOR ALANINE DIPEPTIDE
Authors: MARRONE TJ GILSON MK MCCAMMON JA
Citation: Tj. Marrone et al., COMPARISON OF CONTINUUM AND EXPLICIT MODELS OF SOLVATION - POTENTIALSOF MEAN FORCE FOR ALANINE DIPEPTIDE, Journal of physical chemistry, 100(5), 1996, pp. 1439-1441
BINDING OF TACRINE AND 6-CHLOROTACRINE BY ACETYLCHOLINESTERASE
Authors: WLODEK ST ANTOSIEWICZ J MCCAMMON JA STRAATSMA TP GILSON MK BRIGGS JM HUMBLET C SUSSMAN JL
Citation: St. Wlodek et al., BINDING OF TACRINE AND 6-CHLOROTACRINE BY ACETYLCHOLINESTERASE, Biopolymers, 38(1), 1996, pp. 109-117
PREDICTION OF PROTEIN PKAS - INFLUENCE OF PARAMETERS UPON ACCURACY FOR 4 PROTEINS
Authors: ANTOSIEWICZ J MCCAMMON JA GILSON MK
Citation: J. Antosiewicz et al., PREDICTION OF PROTEIN PKAS - INFLUENCE OF PARAMETERS UPON ACCURACY FOR 4 PROTEINS, Biophysical journal, 70(2), 1996, pp. 413-413
A SYSTEMATIC-APPROACH TO THE DEVELOPMENT AND VALIDATION OF MODELS FORPROTEIN LIGAND-BINDING
Authors: GIVEN JA GILSON MK
Citation: Ja. Given et Mk. Gilson, A SYSTEMATIC-APPROACH TO THE DEVELOPMENT AND VALIDATION OF MODELS FORPROTEIN LIGAND-BINDING, Biophysical journal, 70(2), 1996, p.
THE DETERMINANTS OF PK(A)S IN PROTEINS
Authors: ANTOSIEWICZ J MCCAMMON JA GILSON MK
Citation: J. Antosiewicz et al., THE DETERMINANTS OF PK(A)S IN PROTEINS, Biochemistry, 35(24), 1996, pp. 7819-7833
THEORY OF ELECTROSTATIC INTERACTIONS IN MACROMOLECULES
Authors: GILSON MK
Citation: Mk. Gilson, THEORY OF ELECTROSTATIC INTERACTIONS IN MACROMOLECULES, Current opinion in structural biology, 5(2), 1995, pp. 216-223
MOLECULAR-DYNAMICS SIMULATION WITH A CONTINUUM ELECTROSTATIC MODEL OFTHE SOLVENT
Authors: GILSON MK
Citation: Mk. Gilson, MOLECULAR-DYNAMICS SIMULATION WITH A CONTINUUM ELECTROSTATIC MODEL OFTHE SOLVENT, Journal of computational chemistry, 16(9), 1995, pp. 1081-1095
ELECTROSTATICS AND DIFFUSION OF MOLECULES IN SOLUTION - SIMULATIONS WITH THE UNIVERSITY-OF-HOUSTON BROWNIAN DYNAMICS PROGRAM
Authors: MADURA JD BRIGGS JM WADE RC DAVIS ME LUTY BA ILIN A ANTOSIEWICZ J GILSON MK BAGHERI B SCOTT LR MCCAMMON JA
Citation: Jd. Madura et al., ELECTROSTATICS AND DIFFUSION OF MOLECULES IN SOLUTION - SIMULATIONS WITH THE UNIVERSITY-OF-HOUSTON BROWNIAN DYNAMICS PROGRAM, Computer physics communications, 91(1-3), 1995, pp. 57-95
ACETYLCHOLINESTERASE - DIFFUSIONAL ENCOUNTER RATE CONSTANTS FOR DUMBBELL MODELS OF LIGAND
Authors: ANTOSIEWICZ J GILSON MK LEE IH MCCAMMON JA
Citation: J. Antosiewicz et al., ACETYLCHOLINESTERASE - DIFFUSIONAL ENCOUNTER RATE CONSTANTS FOR DUMBBELL MODELS OF LIGAND, Biophysical journal, 68(1), 1995, pp. 62-68
SIMULATION OF CHARGE-MUTANT ACETYLCHOLINESTERASES
Authors: ANTOSIEWICZ J MCCAMMON JA WLODEK ST GILSON MK
Citation: J. Antosiewicz et al., SIMULATION OF CHARGE-MUTANT ACETYLCHOLINESTERASES, Biochemistry, 34(13), 1995, pp. 4211-4219
OPEN BACK DOOR IN A MOLECULAR-DYNAMICS SIMULATION OF ACETYLCHOLINESTERASE
Authors: GILSON MK STRAATSMA TP MCCAMMON JA RIPOLL DR FAERMAN CH AXELSEN PH SILMAN I SUSSMAN JL
Citation: Mk. Gilson et al., OPEN BACK DOOR IN A MOLECULAR-DYNAMICS SIMULATION OF ACETYLCHOLINESTERASE, Science, 263(5151), 1994, pp. 1276-1278
PREDICTION OF PH-DEPENDENT PROPERTIES OF PROTEINS
Authors: ANTOSIEWICZ J MCCAMMON JA GILSON MK
Citation: J. Antosiewicz et al., PREDICTION OF PH-DEPENDENT PROPERTIES OF PROTEINS, Journal of Molecular Biology, 238(3), 1994, pp. 415-436
ACETYLCHOLINESTERASE - EFFECTS OF IONIC-STRENGTH AND DIMERIZATION ON THE RATE CONSTANTS
Authors: ANTOSIEWICZ J GILSON MK MCCAMMON JA
Citation: J. Antosiewicz et al., ACETYLCHOLINESTERASE - EFFECTS OF IONIC-STRENGTH AND DIMERIZATION ON THE RATE CONSTANTS, Israel Journal of Chemistry, 34(2), 1994, pp. 151-158
PREDICTION OF PKAS OF IONIZABLE GROUPS IN PROTEINS
Authors: GILSON MK ANTOSIEWICZ J MCCAMMON JA
Citation: Mk. Gilson et al., PREDICTION OF PKAS OF IONIZABLE GROUPS IN PROTEINS, Biophysical journal, 66(2), 1994, pp. 10000290-10000290
MOLECULE PK(A) PREDICTION WITH CONTINUUM ELECTROSTATICS CALCULATIONS
Authors: POTTER MJ GILSON MK MCCAMMON JA
Citation: Mj. Potter et al., MOLECULE PK(A) PREDICTION WITH CONTINUUM ELECTROSTATICS CALCULATIONS, Journal of the American Chemical Society, 116(22), 1994, pp. 10298-10299
Risultati: 1-25 |