Publications

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352 Publications visible to you, out of a total of 352

Simulation of Enzyme-Substrate Encounter with Gated Active Sites

Molecular and Cellular Modeling

Abstract

Not specified

Authors: Rebecca C. Wade, Brock A. Luty, Eugene Demchuk, Jeffry D. Madura, Malcolm E. Davis, James M. Briggs, J. Andrew McCammon

Date Published: 1994

Publication Type: Journal

DOI: 10.1038/nsb0194-65

Citation: Nat Struct Mol Biol 1(1):65-69

Created: 13th Dec 2019 at 11:53, Last updated: 5th Mar 2024 at 21:24

Rational Modification of Human Synovial Fluid Phospholipase A2 Inhibitors

Molecular and Cellular Modeling

Abstract

Not specified

Authors: M. Teresa Pisabarro, Angel R. Ortiz, Albert Palomer, Francesc Cabre, Luisa Garcia, Rebecca C. Wade, Federico Gago, David Mauleon, Germano Carganico

Date Published: 1994

Publication Type: Journal

DOI: 10.1021/jm00029a004

Citation: J. Med. Chem. 37(3):337-341

Created: 13th Dec 2019 at 11:53, Last updated: 5th Mar 2024 at 21:24

Receptor binding properties of four-helix-bundle growth factors deduced from electrostatic analysis

Molecular and Cellular Modeling

Abstract

Not specified

Authors: Eugene Demchuk, Thomas Mueller, Hartmut Oschkinat, Walter Sebald, Rebecca C. Wade

Date Published: 1994

Publication Type: Journal

DOI: 10.1002/pro.5560030607

Citation: Protein Science 3(6):920-935

Created: 13th Dec 2019 at 11:53, Last updated: 5th Mar 2024 at 21:24

Homology Modeling of the Abl-SH3 domain

Molecular and Cellular Modeling

Abstract

Not specified

Authors: M. T. Pisabarro, A. R. Ortiz, L. Serrano, R. C. Wade

Date Published: 1994

Publication Type: Journal

DOI: 10.1002/prot.340200302

Citation: Proteins 20(3):203-215

Created: 13th Dec 2019 at 11:53, Last updated: 5th Mar 2024 at 21:24

Brownian Dynamics Simulations of Diffusional Encounters between Triose Phosphate Isomerase and Glyceraldhyde Phosphate: Electrostatic Steering of Glyceraldehyde Phosphate

Molecular and Cellular Modeling

Abstract

Not specified

Authors: Brock A. Luty, Rebecca C. Wade, Jeffry D. Madura, Malcolm E. Davis, James M. Briggs, J. Andrew McCammon

Date Published: 1993

Publication Type: Journal

DOI: 10.1021/j100103a040

Citation: J. Phys. Chem. 97(1):233-237

Created: 13th Dec 2019 at 11:54, Last updated: 5th Mar 2024 at 21:24

Gating of the Active Site of Triose Phosphate Isomerase: Brownian Dynamics Simulations of Flexible Peptide Loops in the Enzyme

Molecular and Cellular Modeling

Abstract

Not specified

Authors: R.C. Wade, M.E. Davis, B.A. Luty, J.D. Madura, J.A. McCammon

Date Published: 1993

Publication Type: Journal

DOI: 10.1016/S0006-3495(93)81335-3

Citation: Biophysical Journal 64(1):9-15

Created: 13th Dec 2019 at 11:54, Last updated: 5th Mar 2024 at 21:24

Further Development of Hydrogen-Bond Functions for Use in Determining Energetically Favorable Binding Sites on Molecules of Known Structure. 1. Ligand Probe Groups with the Ability To Form Two Hydrogen Bonds

Molecular and Cellular Modeling

Abstract

Not specified

Authors: Rebecca C. Wade, Kevin J. Clark, Peter J. Goodford

Date Published: 1993

Publication Type: Journal

DOI: 10.1021/jm00053a018

Citation: J. Med. Chem. 36(1):140-147

Created: 13th Dec 2019 at 11:54, Last updated: 5th Mar 2024 at 21:24

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