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1

Computational Methods in Drug Discovery

Sliwoski, G., Kothiwale, S., Meiler, J., Lowe, E. W.

Journal:

Pharmacological Reviews

Year:

2013

Language:

english

File:

PDF, 3.21 MB

english, 2013

2

A review on Spirulina: alternative media for cultivation and nutritive value as an aquafeed

Ragaza, Janice Alano, Hossain, Md. Sakhawat, Meiler, Kristen A., Velasquez, Stephanie F., Kumar, Vikas

Journal:

Reviews in Aquaculture

Year:

2020

File:

PDF, 808 KB

2020

3

Characterization of high-power lithium-ion batteries by electrochemical impedance spectroscopy. II: Modelling

D. Andre, M. Meiler, K. Steiner, H. Walz, T. Soczka-Guth, D.U. Sauer

Journal:

Journal of Power Sources

Year:

2011

Language:

english

File:

PDF, 1.71 MB

english, 2011

4

Tibial plateau levelling osteotomy in eleven cats with cranial cruciate ligament rupture

Mindner, Julia, Bielecki, Malgorzata, Scharvogel, Stefan, Meiler, Diane

Journal:

Veterinary and Comparative Orthopaedics and Traumatology

Year:

2016

Language:

english

File:

PDF, 528 KB

english, 2016

5

Characterization of high-power lithium-ion batteries by electrochemical impedance spectroscopy. I. Experimental investigation

D. Andre, M. Meiler, K. Steiner, Ch. Wimmer, T. Soczka-Guth, D.U. Sauer

Journal:

Journal of Power Sources

Year:

2011

Language:

english

File:

PDF, 904 KB

english, 2011

6

State-of-health monitoring of lithium-ion batteries in electric vehicles by on-board internal resistance estimation

Jürgen Remmlinger, Michael Buchholz, Markus Meiler, Peter Bernreuter, Klaus Dietmayer

Journal:

Journal of Power Sources

Year:

2011

Language:

english

File:

PDF, 386 KB

english, 2011

7

A Holistic Approach to Partial Covalent Interactions in Protein Structure Prediction and Design with Rosetta

Combs, Steven Anthony, Mueller, Benjamin Keymar, Meiler, Jens

Journal:

Journal of Chemical Information and Modeling

Year:

2018

Language:

english

File:

PDF, 5.66 MB

english, 2018

8

[IEEE 2012 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology (CIBCB) - San Diego, CA, USA (2012.05.9-2012.05.12)] 2012 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology (CIBCB) - Bcl∷ChemInfo - Qualitative analysis of machine learning models for activation of HSD involved in Alzheimer's Disease

Butkiewicz, Mariusz, Lowe, Edward W., Meiler, Jens

Year:

2012

Language:

english

File:

PDF, 1.57 MB

english, 2012

9

[IEEE 2012 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology (CIBCB) - San Diego, CA (2012.05.9-2012.05.12)] 2012 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology (CIBCB) - GPU-accelerated machine learning techniques enable QSAR modeling of large HTS data

Lowe, E. W., Butkiewicz, M., Woetzel, N., Meiler, J.

Year:

2012

Language:

english

File:

PDF, 1.19 MB

english, 2012

10

Effects of Steam-Distilled Shoot Extract of Tagetes minuta (Asterales: Asteraceae) and Entomopathogenic Fungi on Larval Tetanops myopaeformis

Dunkel, Florence V., Jaronski, Stefan T., Sedlak, Christopher W., Meiler, Svenja U., Veo, Kendra D.

Journal:

Environmental Entomology

Year:

2010

Language:

english

File:

PDF, 134 KB

english, 2010

11

Histopathological regression after neoadjuvant docetaxel, oxaliplatin, fluorouracil, and leucovorin versus epirubicin, cisplatin, and fluorouracil or capecitabine in patients with resectable gastric or gastro-oesophageal junction adenocarcinoma (FLOT4-AIO): results from the phase 2 part of a multicentre, open-label, randomised phase 2/3 trial

Al-Batran, Salah-Eddin, Hofheinz, Ralf D, Pauligk, Claudia, Kopp, Hans-Georg, Haag, Georg Martin, Luley, Kim Barbara, Meiler, Johannes, Homann, Nils, Lorenzen, Sylvie, Schmalenberg, Harald, Probst, St

Journal:

The Lancet Oncology

Year:

2016

Language:

english

File:

PDF, 325 KB

english, 2016

12

ROSETTALIGAND: Protein–small molecule docking with full side-chain flexibility

Jens Meiler, David Baker

Journal:

Proteins: Structure, Function, and Bioinformatics

Year:

2006

Language:

english

File:

PDF, 760 KB

english, 2006

13

CHARGE-Assoziation: Störung der Wachstumshormon-IGF-1-Achse als mögliche Ursache des Kleinwuchses Fallbericht

M. Bauer, B. Meiler, H. Schmidt, H. P. Schwarz, W. Kiess

Journal:

Monatsschrift Kinderheilkunde

Year:

1998

Language:

german

File:

PDF, 106 KB

german, 1998

14

Solvent accessible surface area approximations for rapid and accurate protein structure prediction

Elizabeth Durham, Brent Dorr, Nils Woetzel, René Staritzbichler, Jens Meiler

Journal:

Journal of Molecular Modeling

Year:

2009

Language:

english

File:

PDF, 492 KB

english, 2009

15

A new approach for applying residual dipolar couplings as restraints in structure elucidation

Jens Meiler, Niklas Blomberg, Michael Nilges, Christian Griesinger

Journal:

Journal of Biomolecular NMR

Year:

2000

Language:

english

File:

PDF, 148 KB

english, 2000

16

The hydrochemical identification of groundwater flowing to the Bet She’an-Harod multiaquifer system (Lower Jordan Valley) by rare earth elements, yttrium, stable isotopes (H, O) and Tritium

Christian Siebert, Eliahu Rosenthal, Peter Möller, Tino Rödiger, Miki Meiler

Journal:

Applied Geochemistry

Year:

2012

Language:

english

File:

PDF, 1.73 MB

english, 2012

17

Recognition Dynamics Up to Microseconds Revealed from an RDC-Derived Ubiquitin Ensemble in Solution

Lange, O. F., Lakomek, N.-A., Fares, C., Schroder, G. F., Walter, K. F. A., Becker, S., Meiler, J., Grubmuller, H., Griesinger, C., de Groot, B. L.

Journal:

Year:

2008

Language:

english

File:

PDF, 1.20 MB

english, 2008

18

Small-molecule ligand docking into comparative models with Rosetta

Combs, Steven A, DeLuca, Samuel L, DeLuca, Stephanie H, Lemmon, Gordon H, Nannemann, David P, Nguyen, Elizabeth D, Willis, Jordan R, Sheehan, Jonathan H, Meiler, Jens

Journal:

Bioentrepreneur

Year:

2013

Language:

english

File:

PDF, 1.66 MB

english, 2013

19

Simultaneous prediction of binding free energy and specificity for PDZ domain–peptide interactions

Crivelli, Joseph J., Lemmon, Gordon, Kaufmann, Kristian W., Meiler, Jens

Journal:

Journal of Computer-Aided Molecular Design

Year:

2013

Language:

english

File:

PDF, 749 KB

english, 2013

20

Opportunities and challenges in the discovery of allosteric modulators of GPCRs for treating CNS disorders

Conn, P. Jeffrey, Lindsley, Craig W., Meiler, Jens, Niswender, Colleen M.

Journal:

Nature Reviews Drug Discovery

Year:

2014

Language:

english

File:

PDF, 1.41 MB

english, 2014

21

[IEEE 2011 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology - Part of 17273 - 2011 Ssci - Paris, France (2011.04.11-2011.04.15)] 2011 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology (CIBCB) - Comparative analysis of machine learning techniques for the prediction of logP

Lowe, Edward W., Butkiewicz, Mariusz, Spellings, Matthew, Omlor, Albert, Meiler, Jens

Year:

2011

Language:

english

File:

PDF, 515 KB

english, 2011

22

Tunneling dynamics of doped organic low-temperature glasses as probed by a photophysical hole-burning system

Köhler, W., Meiler, J., Friedrich, J.

Journal:

Physical Review B

Year:

1987

Language:

english

File:

PDF, 323 KB

english, 1987

23

[IEEE 2011 IEEE 1st International Conference on Computational Advances in Bio and Medical Sciences (ICCABS) - Orlando, FL, USA (2011.02.3-2011.02.5)] 2011 IEEE 1st International Conference on Computational Advances in Bio and Medical Sciences (ICCABS) - Bcl::Cluster: A method for clustering biological molecules coupled with visualization in the Pymol Molecular Graphics System

Alexander, Nathan, Woetzel, Nils, Meiler, Jens

Year:

2011

Language:

english

File:

PDF, 461 KB

english, 2011

24

Personalized Biochemistry and Biophysics

Kroncke, Brett M., Vanoye, Carlos G., Meiler, Jens, George, Alfred L., Sanders, Charles R.

Journal:

Year:

2015

Language:

english

File:

PDF, 468 KB

english, 2015

25

A seismic interpretation of the Bet She'an basin

Meiler, Miki, Shulman, Haim, Flexer, Akiva, Reshef, Moshe, Yellin-Dror, Anat

Journal:

Israel Journal of Earth Sciences

Year:

2008

Language:

english

File:

PDF, 14.46 MB

english, 2008

26

A well-type ionization chamber geometric correction factor

Meiler, R J, Sibata, C H, Ho, A K, Souza, C de, Shin, K H

Journal:

Physics in Medicine and Biology

Year:

1996

Language:

english

File:

PDF, 121 KB

english, 1996

27

EGFR kinase domain duplication (EGFR-KDD) is a novel oncogenic driver in lung cancer that is clinically responsive to afatinib

Gallant, J.-N., Sheehan, J. H., Shaver, T. M., Bailey, M., Lipson, D., Chandramohan, R., Red Brewer, M., York, S. J., Kris, M. G., Pietenpol, J. A., Ladanyi, M., Miller, V. A., Ali, S. M., Meiler, J.,

Journal:

Cancer Discovery

Year:

2015

Language:

english

File:

PDF, 783 KB

english, 2015

28

BCL::SAXS: GPU accelerated Debye method for computation of small angle X-ray scattering profiles

Putnam, Daniel K., Weiner, Brian E., Woetzel, Nils, Lowe, Edward W., Meiler, Jens

Journal:

Proteins: Structure, Function, and Bioinformatics

Year:

2015

Language:

english

File:

PDF, 628 KB

english, 2015

29

Anesthesia drugs, immunity, and long-term outcome

Homburger, Jay A, Meiler, Steffen E

Journal:

Current Opinion in Anaesthesiology

Year:

2006

Language:

english

File:

PDF, 131 KB

english, 2006

30

An Empirical Stationary Fuel Cell Model Using Limited Experimental Data for Identification

Meiler, M., Hofer, E. P., Nuhic, A., Schmid, O.

Journal:

Journal of Fuel Cell Science and Technology

Year:

2012

Language:

english

File:

PDF, 936 KB

english, 2012

31

The Predictive Power of Different Types of Experimental Restraints in Small Molecule Docking: A Review

Fu, Darwin Yu, Meiler, Jens

Journal:

Journal of Chemical Information and Modeling

Year:

2017

Language:

english

File:

PDF, 1.14 MB

english, 2017

32

The molecular basis of subtype selectivity of human kinin G-protein-coupled receptors

Joedicke, Lisa, Mao, Jiafei, Kuenze, Georg, Reinhart, Christoph, Kalavacherla, Tejaswi, Jonker, Hendrik R A, Richter, Christian, Schwalbe, Harald, Meiler, Jens, Preu, Julia, Michel, Hartmut, Glaubitz,

Journal:

Nature Chemical Biology

Year:

2018

Language:

english

File:

PDF, 3.03 MB

english, 2018

33

Pharmacological evaluation of new constituents of “Spice”: synthetic cannabinoids based on indole, indazole, benzimidazole and carbazole scaffolds

Schoeder, Clara T., Hess, Cornelius, Madea, Burkhard, Meiler, Jens, Müller, Christa E.

Journal:

Forensic Toxicology

Year:

2018

Language:

english

File:

PDF, 4.28 MB

english, 2018

34

Human Rotavirus VP6-Specific Antibodies Mediate Intracellular Neutralization by Binding to a Quaternary Structure in the Transcriptional Pore

Aiyegbo, Mohammed S., Sapparapu, Gopal, Spiller, Benjamin W., Eli, Ilyas M., Williams, Dewight R., Kim, Robert, Lee, David E., Liu, Tong, Li, Sheng, Woods, Virgil L., Nannemann, David P., Meiler, Jens

Journal:

Year:

2013

Language:

english

File:

PDF, 5.92 MB

english, 2013

35

Benchmarking Ligand-Based Virtual High-Throughput Screening with the PubChem Database

Butkiewicz, Mariusz, Lowe, Edward, Mueller, Ralf, Mendenhall, Jeffrey, Teixeira, Pedro, Weaver, C., Meiler, Jens

Journal:

Year:

2013

Language:

english

File:

PDF, 268 KB

english, 2013

36

BCL::Mol2D—a robust atom environment descriptor for QSAR modeling and lead optimization

Vu, Oanh, Mendenhall, Jeffrey, Altarawy, Doaa, Meiler, Jens

Journal:

Journal of Computer-Aided Molecular Design

Year:

2019

Language:

english

File:

PDF, 968 KB

english, 2019

37

Integrated Structural Biology for Alpha-Helical Membrane Protein Structure Determination

Journal:

Biophysical Journal

Year:

2019

Language:

english

File:

PDF, 39 KB

english, 2019

38

A unified structural model of the mammalian translocator protein (TSPO)

Xia, Yan, Ledwitch, Kaitlyn, Kuenze, Georg, Duran, Amanda, Li, Jun, Sanders, Charles R., Manning, Charles, Meiler, Jens

Journal:

Journal of Biomolecular NMR

Year:

2019

Language:

english

File:

PDF, 2.28 MB

english, 2019

39

Protein structure prediction using sparse NOE and RDC restraints with Rosetta in CASP13

Kuenze, Georg, Meiler, Jens

Journal:

Proteins: Structure, Function, and Bioinformatics

Year:

2019

Language:

english

File:

PDF, 1.95 MB

english, 2019

40

High-Throughput Screening Assay Datasets from the PubChem Database

Butkiewicz, Mariusz, Wang, Yanli, Bryant, Stephen H, W Lowe Jr, Edward, Weaver C, David, Meiler, Jens

Journal:

Chemical Informatics

Year:

2017

Language:

english

File:

PDF, 553 KB

english, 2017

41

A Structural Model of the Complex Formed by Phospholamban and the Calcium Pump of Sarcoplasmic Reticulum Obtained by Molecular Mechanics

Michael C. Hutter, Joachim Krebs, Jens Meiler, Christian Griesinger, Ernesto Carafoli, Volkhard Helms

Journal:

Year:

2002

Language:

english

File:

PDF, 790 KB

english, 2002

42

NMR Structure Determination of Saccharose and Raffinose by Means of Homo- and Heteronuclear Dipolar Couplings

Heike Neubauer, Jens Meiler, Wolfgang Peti, Christian Griesinger

Journal:

Helvetica Chimica Acta

Year:

2001

Language:

english

File:

PDF, 215 KB

english, 2001

43

The High-Resolution Solution Structure of Epothilone A Bound to Tubulin: An Understanding of the Structure–Activity Relationships for a Powerful Class of Antitumor Agents

Teresa Carlomagno, Marcel J. J. Blommers, Jens Meiler, Wolfgang Jahnke, Thomas Schupp, Frank Petersen, Dieter Schinzer, Karl-Heinz Altmann, Christian Griesinger

Journal:

Angewandte Chemie

Year:

2003

Language:

english

File:

PDF, 122 KB

english, 2003

44

Titelbild: The High-Resolution Solution Structure of Epothilone A Bound to Tubulin: An Understanding of the Structure–Activity Relationships for a Powerful Class of Antitumor Agents (Angew. Chem. 22/2003)

Teresa Carlomagno, Marcel J. J. Blommers, Jens Meiler, Wolfgang Jahnke, Thomas Schupp, Frank Petersen, Dieter Schinzer, Karl-Heinz Altmann, Christian Griesinger

Journal:

Angewandte Chemie

Year:

2003

File:

PDF, 22 KB

2003

45

The INPHARMA Method: Protein-Mediated Interligand NOEs for Pharmacophore Mapping

Víctor M. Sánchez-Pedregal, Marcel Reese, Jens Meiler, Marcel J. J. Blommers, Christian Griesinger, Teresa Carlomagno

Journal:

Angewandte Chemie

Year:

2005

Language:

english

File:

PDF, 354 KB

english, 2005

46

Side-Chain Orientation and Hydrogen-Bonding Imprint Supra-τc Motion on the Protein Backbone of Ubiquitin

Nils A. Lakomek, Christophe Farès, Stefan Becker, Teresa Carlomagno, Jens Meiler, Christian Griesinger

Journal:

Angewandte Chemie

Year:

2005

Language:

english

File:

PDF, 335 KB

english, 2005

47

The Tubulin-Bound Conformation of Discodermolide Derived by NMR Studies in Solution Supports a Common Pharmacophore Model for Epothilone and Discodermolide

Víctor M. Sánchez-Pedregal, Karel Kubicek, Jens Meiler, Isabelle Lyothier, Ian Paterson, Teresa Carlomagno

Journal:

Angewandte Chemie

Year:

2006

Language:

english

File:

PDF, 540 KB

english, 2006

48

Structural Basis of the Activity of the Microtubule-Stabilizing Agent Epothilone A Studied by NMR Spectroscopy in Solution

Marcel Reese, Víctor M. Sánchez-Pedregal, Karel Kubicek, Jens Meiler, Marcel J. J. Blommers, Christian Griesinger, Teresa Carlomagno

Journal:

Angewandte Chemie

Year:

2007

Language:

english

File:

PDF, 444 KB

english, 2007

49

The High-Resolution Solution Structure of Epothilone A Bound to Tubulin: An Understanding of the Structure–Activity Relationships for a Powerful Class of Antitumor Agents

Teresa Carlomagno, Marcel J. J. Blommers, Jens Meiler, Wolfgang Jahnke, Thomas Schupp, Frank Petersen, Dieter Schinzer, Karl-Heinz Altmann, Christian Griesinger

Journal:

Angewandte Chemie International Edition

Year:

2003

Language:

english

File:

PDF, 122 KB

english, 2003

50

Cover Picture: The High-Resolution Solution Structure of Epothilone A Bound to Tubulin: An Understanding of the Structure–Activity Relationships for a Powerful Class of Antitumor Agents (Angew. Chem. Int. Ed. 22/2003)

Teresa Carlomagno, Marcel J. J. Blommers, Jens Meiler, Wolfgang Jahnke, Thomas Schupp, Frank Petersen, Dieter Schinzer, Karl-Heinz Altmann, Christian Griesinger

Journal:

Angewandte Chemie International Edition

Year:

2003

File:

PDF, 22 KB

2003