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Results: 1-25/49
Authors:
WORTH GA
NARDI F
WADE RC
Citation: Ga. Worth et al., USE OF MULTIPLE MOLECULAR-DYNAMICS TRAJECTORIES TO STUDY BIOMOLECULESIN SOLUTION - THE YTGP PEPTIDE, JOURNAL OF PHYSICAL CHEMISTRY B, 102(32), 1998, pp. 6260-6272
Authors:
GABDOULLINE RR
WADE RC
Citation: Rr. Gabdoulline et Rc. Wade, BROWNIAN DYNAMICS SIMULATION OF PROTEIN-PROTEIN DIFFUSIONAL ENCOUNTER, Methods, 14(3), 1998, pp. 329-341
Authors:
WADE RC
ORTIZ AR
GAGO F
Citation: Rc. Wade et al., COMPARATIVE BINDING-ENERGY ANALYSIS, Perspectives in drug discovery and design, 9-11, 1998, pp. 19-34
Authors:
TOMIC S
GABDOULLINE RR
KOJICPRODIC B
WADE RC
Citation: S. Tomic et al., CLASSIFICATION OF AUXIN PLANT HORMONES BY INTERACTION PROPERTY SIMILARITY INDEXES, Journal of computer-aided molecular design, 12(1), 1998, pp. 63-79
Authors:
HELMS V
WADE RC
Citation: V. Helms et Rc. Wade, HYDRATION ENERGY LANDSCAPE OF THE ACTIVE-SITE CAVITY IN CYTOCHROME P450CAM, Proteins, 32(3), 1998, pp. 381-396
Authors:
WADE RC
GABDOULLINE RR
LUTY BA
Citation: Rc. Wade et al., SPECIES DEPENDENCE OF ENZYME-SUBSTRATE ENCOUNTER RATES FOR TRIOSE PHOSPHATE ISOMERASES, Proteins, 31(4), 1998, pp. 406-416
Authors:
EHRLICH L
RECZKO M
BOHR H
WADE RC
Citation: L. Ehrlich et al., PREDICTION OF PROTEIN HYDRATION SITES FROM SEQUENCE BY MODULAR NEURALNETWORKS, Protein engineering, 11(1), 1998, pp. 11-19
Authors:
WADE RC
Citation: Rc. Wade, EDUCATION FOR PUBLIC DEMOCRACY - SEHR,DT, Theory and research in social education, 26(2), 1998, pp. 288-293
Authors:
WADE RC
GABDOULLINE RR
LUDEMANN SK
LOUNNAS V
Citation: Rc. Wade et al., ELECTROSTATIC STEERING AND IONIC TETHERING IN ENZYME-LIGAND BINDING -INSIGHTS FROM SIMULATIONS, Proceedings of the National Academy of Sciences of the United Statesof America, 95(11), 1998, pp. 5942-5949
Authors:
IBRAGIMOVA GT
WADE RC
Citation: Gt. Ibragimova et Rc. Wade, IMPORTANCE OF EXPLICIT SALT IONS FOR PROTEIN STABILITY IN MOLECULAR-DYNAMICS SIMULATION, Biophysical journal, 74(6), 1998, pp. 2906-2911
Authors:
SHRIVASTAVA IH
LOUNNAS V
WADE RC
Citation: Ih. Shrivastava et al., ENERGETICS OF SALT-LINKS IN PROTEINS - A COMPARISON OF GLUTAMATE-DEHYDROGENASE FROM HYPERTHERMOPHILIC PYROCOCCUS-FURIOSUS AND MESOPHILIC CLOSTRIDIUM-SYMBIOSUM, Biophysical journal, 74(2), 1998, pp. 173-173
Authors:
HELMS V
WADE RC
Citation: V. Helms et Rc. Wade, COMPUTATIONAL ALCHEMY TO CALCULATE ABSOLUTE PROTEIN-LIGAND BINDING FREE-ENERGY, Journal of the American Chemical Society, 120(12), 1998, pp. 2710-2713
Authors:
LUDEMANN SK
CARUGO O
WADE RC
Citation: Sk. Ludemann et al., SUBSTRATE ACCESS TO CYTOCHROME P450CAM - A COMPARISON OF A THERMAL MOTION PATHWAY ANALYSIS WITH MOLECULAR-DYNAMICS SIMULATION DATA, JOURNAL OF MOLECULAR MODELING, 3(8), 1997, pp. 369-374
Authors:
NARDI F
WORTH GA
WADE RC
Citation: F. Nardi et al., LOCAL INTERACTIONS OF AROMATIC RESIDUES IN SHORT PEPTIDES IN AQUEOUS-SOLUTION - A COMBINED DATABASE AND ENERGETIC ANALYSIS, Folding & design, 2(4), 1997, pp. 62-68
Authors:
WADE RC
Citation: Rc. Wade, FLU AND STRUCTURE-BASED DRUG DESIGN, Structure, 5(9), 1997, pp. 1139-1145
Authors:
LUDEMANN SK
WADE RC
Citation: Sk. Ludemann et Rc. Wade, SUBSTRATE ACCESS TO CYTOCHROME P450CAM INVESTIGATED BY COMPUTER-SIMULATIONS, The FASEB journal, 11(9), 1997, pp. 77-77
Authors:
SOBOLEV V
MOALLEM TM
WADE RC
VRIEND G
EDELMAN M
Citation: V. Sobolev et al., CASP2 MOLECULAR DOCKING PREDICTIONS WITH THE LIGIN SOFTWARE, Proteins, 1997, pp. 210-214
Authors:
HELMS V
WADE RC
Citation: V. Helms et Rc. Wade, FREE-ENERGIES OF HYDRATION FROM THERMODYNAMIC INTEGRATION - COMPARISON OF MOLECULAR MECHANICS FORCE-FIELDS AND EVALUATION OF CALCULATION ACCURACY, Journal of computational chemistry, 18(4), 1997, pp. 449-462
Authors:
WADE RC
Citation: Rc. Wade, EMPOWERMENT IN STUDENT TEACHING THROUGH COMMUNITY-SERVICE LEARNING, Theory into practice, 36(3), 1997, pp. 184-191
Authors:
ORTIZ AR
PASTOR M
PALOMER A
CRUCIANI G
GAGO F
WADE RC
Citation: Ar. Ortiz et al., RELIABILITY OF COMPARATIVE MOLECULAR-FIELD ANALYSIS MODELS - EFFECTS OF DATA SCALING AND VARIABLE SELECTION USING A SET OF HUMAN SYNOVIAL-FLUID PHOSPHOLIPASE A(2) INHIBITORS, Journal of medicinal chemistry, 40(7), 1997, pp. 1136-1148
PREDICTION OF DRUG-BINDING AFFINITIES BY COMPARATIVE BINDING-ENERGY ANALYSIS (VOL 38, PG 2682, 1995)
Authors:
ORTIZ AR
PISABARRO MT
GAGO F
WADE RC
Citation: Ar. Ortiz et al., PREDICTION OF DRUG-BINDING AFFINITIES BY COMPARATIVE BINDING-ENERGY ANALYSIS (VOL 38, PG 2682, 1995), Journal of medicinal chemistry, 40(25), 1997, pp. 4168-4168
Authors:
ORTIZ AR
PASTOR M
PALOMER A
CRUCIANI G
GAGO F
WADE RC
Citation: Ar. Ortiz et al., RELIABILITY OF COMFA MODELS - EFFECTS OF DATA SCALING AND VARIABLE SELECTION USING A SET OF HUMAN SYNOVIAL-FLUID PHOSPHOLIPASE A(2) INHIBITORS (VOL 40, PG 1138, 1997), Journal of medicinal chemistry, 40(25), 1997, pp. 4168-4168
Authors:
RAQUET X
LOUNNAS V
LAMOTTEBRASSEUR J
FRERE JM
WADE RC
Citation: X. Raquet et al., PK(A) CALCULATIONS FOR CLASS-A BETA-LACTAMASES - METHODOLOGICAL AND MECHANISTIC IMPLICATIONS, Biophysical journal, 73(5), 1997, pp. 2416-2426
Authors:
GABDOULLINE RR
WADE RC
Citation: Rr. Gabdoulline et Rc. Wade, SIMULATION OF THE DIFFUSIONAL ASSOCIATION OF BARNASE AND BARSTAR, Biophysical journal, 72(5), 1997, pp. 1917-1929
Authors:
LOUNNAS V
WADE RC
Citation: V. Lounnas et Rc. Wade, EXCEPTIONALLY STABLE SALT BRIDGES IN CYTOCHROME P450CAM HAVE FUNCTIONAL ROLES, Biochemistry, 36(18), 1997, pp. 5402-5417