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1449 Publications visible to you, out of a total of 1449

Rational design of Human Synovial Fluid Phospholipase A2 inhibitors and analysis of their three-dimensional structure-activity relationships

Molecular and Cellular Modeling

Abstract

Not specified

Author: Angel Ramirez Ortiz

Date Published: 1996

Publication Type: Doctoral Thesis

Citation: University of Alcala de Henares, Madrid

Created: 13th Dec 2019 at 14:28

Hydratation des aktiven Zentrums von Cytochrom P450cam - Untersuchung mit Molekueldynamik-Simulationen

Molecular and Cellular Modeling

Abstract

Not specified

Author: Volkhard Helms

Date Published: 1996

Publication Type: Doctoral Thesis

Citation: Ludwig-Maximilians University, Munich

Created: 13th Dec 2019 at 14:28

Dynamische Einstellung des Parallelitaetsgrades mit reflexiven Programmen

Molecular and Cellular Modeling

Abstract

Not specified

Author: Niels Reimer

Date Published: 1996

Publication Type: Diplom Thesis

Citation: Computer Science, University of Karlsruhe, Tubingen

Created: 12th Feb 2020 at 14:58, Last updated: 21st Mar 2022 at 19:10

Prediction of Drug Binding Affinities by Comparative Binding Energy Analysis: Application to Human Synovial Fluid Phospholipase A2 Inhibitors

Molecular and Cellular Modeling

Abstract

Not specified

Authors: A.R. Ortiz, M.T. Pisabarro, F. Gago, R.C. Wade

Date Published: 1995

Publication Type: InCollection

Citation: In QSAR and Molecular Modelling: Concepts, Computational Tools and Biological Applications, pp. pp439–443, Eds. Sanz,F., Giraldo,J., Manaut,F, J.R. Prous Science Publishers, Barcelona

Created: 13th Dec 2019 at 11:52, Last updated: 13th Dec 2019 at 13:28

Aromatic - (i+2) Amine Interaction in Peptides

Molecular and Cellular Modeling

Abstract

Not specified

Authors: Graham A. Worth, Rebecca C. Wade

Date Published: 1995

Publication Type: Journal

DOI: 10.1021/j100048a025

Citation: J. Phys. Chem. 99(48):17473-17482

Created: 13th Dec 2019 at 11:52, Last updated: 12th Feb 2020 at 17:06

Simulation of enzyme-substrate interactions: the diffusional encounter step

Molecular and Cellular Modeling

Abstract

Not specified

Author: R.C. Wade

Date Published: 1995

Publication Type: Journal

PubMed ID: 8852332

Citation: Acta Bioch. Polon. 42:419–425

Created: 13th Dec 2019 at 11:52, Last updated: 12th Feb 2020 at 17:09

Molecular Dynamics Study of Short Peptide Sequences from BPTI displaying aromatic-amide interactions

Molecular and Cellular Modeling

Abstract

Not specified

Authors: G. Worth, R.C. Wade

Date Published: 1995

Publication Type: InProceedings

Citation: In AIP Conference Proceedings

Created: 13th Dec 2019 at 11:52, Last updated: 12th Feb 2020 at 17:10