Gerhard BARNICKEL: search on Z-Library

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1

LIGSITE: automatic and efficient detection of potential small molecule-binding sites in proteins

Manfred Hendlich, Friedrich Rippmann, Gerhard Barnickel

Journal:

Journal of Molecular Graphics and Modelling

Year:

1997

Language:

english

File:

PDF, 280 KB

english, 1997

2

Molecular Modelling – von der Theorie zur Wirklichkeit

Gerhard Barnickel

Journal:

Chemie in unserer Zeit

Year:

1995

Language:

german

File:

PDF, 3.44 MB

german, 1995

3

Synthesis and dopaminergic activity of some 3-(1,2,3,6-tetrahydro-1-pyridylalkyl)indoles. A novel conformational model to explain structure-activity relationships

Boettcher, Henning, Barnickel, Gerhard, Hausberg, Hans Heinrich, Haase, Anton F., Seyfried, Christoph A., Eiermann, Volker

Journal:

Journal of Medicinal Chemistry

Year:

1992

Language:

english

File:

PDF, 1.51 MB

english, 1992

4

Conformation-based design of two cyclic physalaemin analogues

Günter Hölzemann, Alfred Jonczyk, Volker Eiermann, Klaus C. R. Pachler, Gerhard Barnickel, Domenico Regoli

Journal:

Year:

1991

Language:

english

File:

PDF, 526 KB

english, 1991

5

Quantum chemical studies on the conformational structure of bacterial peptidoglycan. I. MNDO calculations on the glycan moiety

Janardan Singh Yadav, Harald Labischinski, Gerhard Barnickel, Hans Bradaczek

Journal:

Journal of Theoretical Biology

Year:

1981

Language:

english

File:

PDF, 845 KB

english, 1981

6

Vibrational spectroscopic analysis of LD-sequential, bacterial cell wall peptides: An IR and raman study

Dieter Naumann, Harald Labischinski, Wolfgang Rönspeck, Gerhard Barnickel, Hans Bradaczek

Journal:

Year:

1987

Language:

english

File:

PDF, 1.20 MB

english, 1987

7

The comparison of geometric and electronic properties of molecular surfaces by neural networks: Application to the analysis of corticosteroid-binding globulin activity of steroids

Soheila Anzali, Gerhard Barnickel, Michael Krug, Jens Sadowski, Markus Wagener, Johann Gasteiger, Jaroslaw Polanski

Journal:

Journal of Computer-Aided Molecular Design

Year:

1996

Language:

english

File:

PDF, 1.48 MB

english, 1996

8

Comparison between the Molecular and Crystal Structures of a Benzylpenicillin Ester and its Corresponding Sulfoxide with Drastically Reduced Biological Activity

Labischinski, Harald, Naumann, Dieter, Barnickel, Gerhard, Dreißig, Wolfgang, Gruszecki, Wojciech, Hofer, Andreas, Bradaczek, Hans

Journal:

Zeitschrift für Naturforschung B

Year:

1987

Language:

english

File:

PDF, 7.21 MB

english, 1987

9

Quantum chemical studies on the conformational structure of bacterial peptidoglycan. IV. PCILO calculation on the di-saccharide part of the glycan moiety

Janardan Singh Yadav, Gerhard Barnickel, Hans Bradaczek, Harald Labischinski

Journal:

Journal of Theoretical Biology

Year:

1982

Language:

english

File:

PDF, 1.03 MB

english, 1982

10

Do substance P agonists insert into the lipid membrane?

Günter Hölzemann, Hartmut E. Greiner, Jürgen Harting, Gerhard Barnickel, Anna Seelig

Journal:

Regulatory Peptides

Year:

1993

Language:

english

File:

PDF, 121 KB

english, 1993

11

Discriminating between Drugs and Nondrugs by Prediction of Activity Spectra for Substances (PASS)

Anzali, Soheila, Barnickel, Gerhard, Cezanne, Bertram, Krug, Michael, Filimonov, Dmitrii, Poroikov, Vladimir

Journal:

Journal of Medicinal Chemistry

Year:

2001

Language:

english

File:

PDF, 50 KB

english, 2001

12

A Normal Mode-Based Geometric Simulation Approach for Exploring Biologically Relevant Conformational Transitions in Proteins

Ahmed, Aqeel, Rippmann, Friedrich, Barnickel, Gerhard, Gohlke, Holger

Journal:

Journal of Chemical Information and Modeling

Year:

2011

Language:

english

File:

PDF, 4.63 MB

english, 2011

13

Infrared Spectroscopy, a Tool for Probing Bacterial Peptidoglycan : Potentialities of Infrared Spectroscopy for Cell Wall Analytical Studies and Rejection of Models Based on Crystalline Chitin

Dieter NAUMANN, Gerhard BARNICKEL, Hans BRADACZEK, Harald LABISCHINSKI, Peter GIESBRECHT

Journal:

Year:

1982

Language:

english

File:

PDF, 1.04 MB

english, 1982

14

Structural studies on the bacterial cell wall peptidoglycan pseudomurein. I. Conformational energy calculations on the glycan strands in C1 conformation and comparison with murein

Bernd Leps, Gerhard Barnickel, Hans Bradaczek, Harald Labischinski

Journal:

Journal of Theoretical Biology

Year:

1984

Language:

english

File:

PDF, 1.62 MB

english, 1984

15

Selection of Fragments for Kinase Inhibitor Design: Decoration Is Key

Czodrowski, Paul, Hölzemann, Günter, Barnickel, Gerhard, Greiner, Hartmut, Musil, Djordje

Journal:

Journal of Medicinal Chemistry

Year:

2015

Language:

english

File:

PDF, 4.47 MB

english, 2015

16

Study of the Zn-containing dd-carboxypeptidase of Streptomyces albus G by small-angle X-ray scattering in solution

Harald LABISCHINSKI, Peter GIESBRECHT, Erwin FISCHER, Gerhard BARNICKEL, Hans BRADACZEK, Jean-Marie FRÈRE, Claude HOUSSIER, Paulette CHARLIER, Otto DIDEBERG, Jean-Marie GHUYSEN

Journal:

Year:

1984

Language:

english

File:

PDF, 484 KB

english, 1984

17

A new proposal for the primary and secondary structure of the glycan moiety of pseudomurein : Conformational energy calculations on the glycan strands with talosaminuronic acid in 1C conformation and comparison with murein

Bernd LEPS, Harald LABISCHINSKI, Gerhard BARNICKEL, Hans BRADACZEK, Peter GIESBRECHT

Journal:

Year:

1984

Language:

english

File:

PDF, 693 KB

english, 1984

18

On the Secondary and Tertiary Structure of Murein : Low and Medium-Angle X-Ray Evidence against Chitin-Based Conformations of Bacterial Peptidoglycan

Harald LABISCHINSKI, Gerhard BARNICKEL, Hans BRADACZEK, Peter GIESBRECHT

Journal:

Year:

1979

Language:

english

File:

PDF, 1.47 MB

english, 1979

19

Quantum chemical studies on the conformational structure of bacterial peptidoglycan. II. PCILO calculations on the mono-saccharides

Janardan Singh Yadav, Gerhard Barnickel, Hans Bradaczek, Harald Labischinski

Journal:

Journal of Theoretical Biology

Year:

1982

Language:

english

File:

PDF, 901 KB

english, 1982

20

Quantum chemical studies on the conformational structure of bacterial peptidoglycan. III. CNDO and INDO calculations on the N-acetyl-giucosamine

Janardan Singh Yadav, Gerhard Barnickel, Hans Bradaczek, Harald Labischinski

Journal:

Journal of Theoretical Biology

Year:

1982

Language:

english

File:

PDF, 677 KB

english, 1982

21

Conformational Energy Calculation on the Peptide Part of Murein

Gerhard BARNICKEL, Hans BRADACZEK, Harald LABISCHINSKI, Peter GIESBRECHT

Journal:

Year:

1979

Language:

english

File:

PDF, 1009 KB

english, 1979

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