scadsfct > imported

bookmarks (hide)
display
all
bookmarks only
bookmarks per page
5
10
20
50
100
sort by
added at
title
RSS
BibTeX
XML

No matching posts.

⟨⟨
⟨
⟩
⟩⟩

publications (hide)495
display
all
publications only
publications per page
5
10
20
50
100
sort by
added at
title
author
publication date
entry type
help for advanced sorting...
RSS
BibTeX
RDF
more...

1Ligand-based virtual screen for the discovery of novel M5 inhibitor chemotypes
A. Geanes, H. Cho, K. Nance, K. McGowan, P. Conn, C. Jones, J. Meiler, and C. Lindsley. Bioorganic & Medicinal Chemistry Letters, 26 (18): 4487â4491 (September 2016)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Sampling the conformational landscapes of transporters and receptors with AlphaFold2
D. del Alamo, D. Sala, H. Mchaourab, and J. Meiler. (November 2021)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1VUStruct: a compute pipeline for high throughput and personalized structural biology
C. Moth, J. Sheehan, A. Mamun, R. Sivley, A. Gulsevin, D. Rinker, J. Capra, and J. Meiler. (August 2024)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Computer-Aided Design and Biological Evaluation of Diazaspirocyclic D4R Antagonists
C. Jones, B. Brown, D. Schultz, J. Engers, V. Kramlinger, J. Meiler, and C. Lindsley. ACS Chemical Neuroscience, 15 (12): 2396â2407 (June 2024)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1A unified hydrophobicity scale for multispan membrane proteins
J. Koehler, N. Woetzel, R. Staritzbichler, C. Sanders, and J. Meiler. Proteins: Structure, Function, and Bioinformatics, 76 (1): 13â29 (December 2008)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1BCL::Mol2Dâa robust atom environment descriptor for QSAR modeling and lead optimization
O. Vu, J. Mendenhall, D. Altarawy, and J. Meiler. Journal of Computer-Aided Molecular Design, 33 (5): 477â486 (April 2019)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Neural Network Prediction of 13C NMR Chemical Shifts of Substituted Benzenes
J. Meiler, R. Meusinger, and M. Will. Monatshefte fÃ¼r Chemie / Chemical Monthly, 130 (9): 1089â1095 (September 1999)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Improving quantitative structureâactivity relationship models using Artificial Neural Networks trained with dropout
J. Mendenhall, and J. Meiler. Journal of Computer-Aided Molecular Design, 30 (2): 177â189 (February 2016)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
13D-QSAR CoMFA study of benzoxazepine derivatives as mGluR5 positive allosteric modulators
E. Lowe, A. Ferrebee, A. Rodriguez, P. Conn, and J. Meiler. Bioorganic & Medicinal Chemistry Letters, 20 (19): 5922â5924 (October 2010)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Heterogeneity of the GFP fitness landscape and data-driven protein design
L. Gonzalez Somermeyer, A. Fleiss, A. Mishin, N. Bozhanova, A. Igolkina, J. Meiler, M. Alaball Pujol, E. Putintseva, K. Sarkisyan, and F. Kondrashov. eLife, (May 2022)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
2General Purpose Structure-Based Drug Discovery Neural Network Score Functions with Human-Interpretable Pharmacophore Maps
B. Brown, J. Mendenhall, A. Geanes, and J. Meiler. Journal of Chemical Information and Modeling, 61 (2): 603â620 (January 2021)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Application of machine learning approaches on quantitative structure activity relationships
M. Butkiewicz, R. Mueller, D. Selic, E. Dawson, and J. Meiler. 2009 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology, (March 2009)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1GPU-accelerated machine learning techniques enable QSAR modeling of large HTS data
E. Lowe, M. Butkiewicz, N. Woetzel, and J. Meiler. 2012 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology (CIBCB), (May 2012)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Bcl&#x2237;ChemInfo - Qualitative analysis of machine learning models for activation of HSD involved in Alzheimerâs Disease
M. Butkiewicz, E. Lowe, and J. Meiler. 2012 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology (CIBCB), (May 2012)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Interpretable deep-learning pKa prediction for small molecule drugs via atomic sensitivity analysis
J. DeCorte, B. Brown, and J. Meiler. (June 2024)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Fast Determination of 13C NMR Chemical Shifts Using Artificial Neural Networks
J. Meiler, R. Meusinger, and M. Will. Journal of Chemical Information and Computer Sciences, 40 (5): 1169â1176 (August 2000)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Predicting the functional impact of KCNQ1 variants with artificial neural networks
S. Phul, G. Kuenze, C. Vanoye, C. Sanders, A. George, and J. Meiler. PLOS Computational Biology, 18 (4): e1010038 (April 2022)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Epothilones: Quantitative Structure Activity Relations Studied by Support Vector Machines and Artificial Neural Networks
A. Bleckmann, and J. Meiler. QSAR & Combinatorial Science, 22 (7): 722â728 (October 2003)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Divergent Pairwise Epistasis in the Context of Unstable Membrane Protein Variants
L. Chamness, C. Kuntz, A. McKee, W. Penn, C. Hemmerich, D. Rusch, H. Woods, Dyotima, J. Meiler, and J. Schlebach. (December 2023)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Template-free prediction of a new monotopic membrane protein fold and assembly by AlphaFold2
A. Gulsevin, B. Han, J. Porta, H. Mchaourab, J. Meiler, and A. Kenworthy. Biophysical Journal, 122 (11): 2041â2052 (June 2023)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Benchmarking Ligand-Based Virtual High-Throughput Screening with the PubChem Database
M. Butkiewicz, E. Lowe, R. Mueller, J. Mendenhall, P. Teixeira, C. Weaver, and J. Meiler. Molecules, 18 (1): 735â756 (January 2013)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Novel methods of automated structure elucidation based on 13C NMR spectroscopy
J. Meiler, and M. KÃ¶ck. Magnetic Resonance in Chemistry, 42 (12): 1042â1045 (October 2004)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Approximating Projections of Conformational Boltzmann Distributions with AlphaFold2 Predictions: Opportunities and Limitations
B. Brown, R. Stein, J. Meiler, and H. Mchaourab. Journal of Chemical Theory and Computation, 20 (3): 1434â1447 (January 2024)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
2Biasing AlphaFold2 to predict GPCRs and kinases with user-defined functional or structural properties
D. Sala, P. Hildebrand, and J. Meiler. Frontiers in Molecular Biosciences, (February 2023)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Approximating conformational Boltzmann distributions with AlphaFold2 predictions
B. Brown, R. Stein, J. Meiler, and H. Mchaourab. (August 2023)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Improved prediction of trans-membrane spans in proteins using an artificial neural network
J. Koehler, R. Mueller, and J. Meiler. 2009 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology, (March 2009)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Comparative analysis of machine learning techniques for the prediction of logP
E. Lowe, M. Butkiewicz, M. Spellings, A. Omlor, and J. Meiler. 2011 IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology (CIBCB), (April 2011)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1Discovery of 2â(2âBenzoxazoyl amino)â4âArylâ5âCyanopyrimidine as Negative Allosteric Modulators (NAMs) of Metabotropic Glutamate Receptorâ5 (mGlu5): From an Artificial Neural Network Virtual Screen to an In Vivo Tool Compound
R. Mueller, E. Dawson, J. Meiler, A. Rodriguez, B. Chauder, B. Bates, A. Felts, J. Lamb, U. Menon, S. Jadhav and 9 other author(s). ChemMedChem, 7 (3): 406â414 (January 2012)
a day ago by @scadsfct
show all tags
imported
topic_lifescience
importedtopic_lifescience
(0)
copydeleteadd this publication to your clipboard
1NetRank Recovers Known Cancer Hallmark Genes as Universal Biomarker Signature for Cancer Outcome Prediction
A. Al-Fatlawi, N. Afrin, C. Ozen, N. Malekian, and M. Schroeder. Frontiers in Bioinformatics, (March 2022)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1Promiscuity in drug discovery on the verge of the structural revolution: recent advances and future chances
S. Bolz, and M. Schroeder. Expert Opinion on Drug Discovery, 18 (9): 973–985 (July 2023)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1A genome-wide scan of wastewater E. coli for genes under positive selection: focusing on mechanisms of antibiotic resistance
N. Malekian, A. Agrawal, T. Berendonk, A. Al-Fatlawi, and M. Schroeder. Scientific Reports, (May 2022)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1Word-based GWAS harnesses the rich potential of genomic data for E. coli quinolone resistance
N. Malekian, S. Sainath, A. Al-Fatlawi, and M. Schroeder. Frontiers in Microbiology, (December 2023)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1A community effort in SARS‐CoV‐2 drug discovery
J. Schimunek, P. Seidl, K. Elez, T. Hempel, T. Le, F. Noé, S. Olsson, L. Raich, R. Winter, H. Gokcan and 142 other author(s). Molecular Informatics, (November 2023)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1An interaction-based drug discovery screen explains known SARS-CoV-2 inhibitors and predicts new compound scaffolds
P. Schake, K. Dishnica, F. Kaiser, C. Leberecht, V. Haupt, and M. Schroeder. Scientific Reports, (June 2023)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1Decomposing compounds enables reconstruction of interaction fingerprints for structure-based drug screening
M. Adasme, S. Bolz, A. Al-Fatlawi, and M. Schroeder. Journal of Cheminformatics, (March 2022)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1Targeting ion channels with ultra-large library screening for hit discovery
K. Melancon, P. Pliushcheuskaya, J. Meiler, and G. Künze. Frontiers in Molecular Neuroscience, (January 2024)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1Ferric reduction by a CYBDOM protein counteracts increased iron availability in root meristems induced by phosphorus deficiency
R. Maniero, C. Picco, A. Hartmann, F. Engelberger, A. Gradogna, J. Scholz-Starke, M. Melzer, G. Künze, A. Carpaneto, N. von Wirén and 1 other author(s). Nature Communications, (January 2024)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1Similar Binding Modes of cGMP Analogues Limit Selectivity in Modulating Retinal CNG Channels via the Cyclic Nucleotide-Binding Domain
P. Pliushcheuskaya, S. Kesh, E. Kaufmann, S. Wucherpfennig, F. Schwede, G. Künze, and V. Nache. ACS Chemical Neuroscience, 15 (8): 1652–1668 (April 2024)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1Structural Studies on the Binding Mode of Bisphenols to PPARγ
A. Useini, I. Schwerin, G. Künze, and N. Sträter. Biomolecules, 14 (6): 640 (May 2024)
4 days ago by @scadsfct
show all tags
topic_lifescience
imported
topic_lifescienceimported
(0)
copydeleteadd this publication to your clipboard
1The First International Workshop on Open Web Search (WOWS)
S. Farzana, M. Fröbe, M. Granitzer, G. Hendriksen, D. Hiemstra, M. Potthast, and S. Zerhoudi. European Conference on Information Retrieval, page 426--431. Springer, (2024)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1Impact and development of an Open Web Index for open web search
M. Granitzer, S. Voigt, N. Fathima, M. Golasowski, C. Guetl, T. Hecking, G. Hendriksen, D. Hiemstra, J. Martinovic, J. Mitrović and 1 other author(s). Journal of the Association for Information Science and Technology, 75 (5): 512--520 (2024)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1Systematic Evaluation of Neural Retrieval Models on the Touché 2020 Argument Retrieval Subset of BEIR
N. Thakur, L. Bonifacio, M. Fröbe, A. Bondarenko, E. Kamalloo, M. Potthast, M. Hagen, and J. Lin. Proceedings of the 47th International ACM SIGIR Conference on Research and Development in Information Retrieval, page 1420–1430. ACM, (July 2024)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1Report on the Dagstuhl Seminar on Frontiers of Information Access Experimentation for Research and Education
C. Bauer, B. Carterette, N. Ferro, N. Fuhr, J. Beel, T. Breuer, C. Clarke, A. Crescenzi, G. Demartini, G. Di Nunzio and 1 other author(s). ACM SIGIR Forum, 57, page 1--28. ACM New York, NY, USA, (2023)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1The Information Retrieval Experiment Platform (Extended Abstract)
M. Fröbe, J. Reimer, S. MacAvaney, N. Deckers, J. Bevendorff, B. Stein, M. Hagen, and M. Potthast. Lernen. Wissen. Daten. Analysen. -- LWDA 2023, page 179--191. CEUR-WS.org, (October 2023)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1The Information Retrieval Experiment Platform (Extended Abstract)
M. Fröbe, J. Reimer, S. MacAvaney, N. Deckers, S. Reich, J. Bevendorff, B. Stein, M. Hagen, and M. Potthast. Proceedings of the Thirty-ThirdInternational Joint Conference on Artificial Intelligence, page 8405–8410. International Joint Conferences on Artificial Intelligence Organization, (August 2024)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1Prototyping Open Web Search Applications with TIRA: A Case Study in Research-oriented Teaching
M. Fröbe, T. Elstner, H. Scells, and M. Potthast. 5th International Symposium on Open Search Technology (OSSYM 2023), International Open Search Symposium, (October 2023)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1Open Web Search at LongEval 2023: Reciprocal Rank Fusion on Automatically Generated Query Variants
M. Fröbe, G. Hendriksen, A. de Vries, and M. Potthast. (2023)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1Overview of Touché 2024: Argumentation Systems
J. Kiesel, {. Cöltekin, M. Heinrich, M. Fröbe, M. Alshomary, B. De Longueville, T. Erjavec, N. Handke, M. Kopp, N. Ljubesić and 1 other author(s). (2024)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1Overview of PAN 2024: Multi-author Writing Style Analysis, Multilingual Text Detoxification, Oppositional Thinking Analysis, and Generative AI Authorship Verification Condensed Lab Overview
A. Ayele, N. Babakov, J. Bevendorff, X. Casals, B. Chulvi, D. Dementieva, A. Elnagar, D. Freitag, M. Fröbe, D. Korencić and 1 other author(s). International Conference of the Cross-Language Evaluation Forum for European Languages, page 231--259. Springer, (2024)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard
1Resources for Combining Teaching and Research in Information Retrieval Coursework
M. Fröbe, H. Scells, T. Elstner, C. Akiki, L. Gienapp, J. Reimer, S. MacAvaney, B. Stein, M. Hagen, and M. Potthast. Proceedings of the 47th International ACM SIGIR Conference on Research and Development in Information Retrieval, page 1115–1125. ACM, (July 2024)
4 days ago by @scadsfct
show all tags
topic_language
imported
topic_languageimported
(0)
copydeleteadd this publication to your clipboard

bookmarks (hide) displayallbookmarks onlybookmarks per page5102050100 sort byadded attitle RSSBibTeXXML

publications (hide)495 displayallpublications onlypublications per page5102050100 sort byadded attitleauthorpublication dateentry typehelp for advanced sorting... RSSBibTeXRDFmore...

browse

related tags

tags

bookmarks (hide)
display
all
bookmarks only
bookmarks per page
5
10
20
50
100
sort by
added at
title
RSS
BibTeX
XML

publications (hide)495
display
all
publications only
publications per page
5
10
20
50
100
sort by
added at
title
author
publication date
entry type
help for advanced sorting...
RSS
BibTeX
RDF
more...