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Handbook of chemoinformatics: from data to knowledge, edited by Johann Gasteiger, Volumes 1–4. Wiley‐VCH, Weinheim, 2003, ISBN 3527306803, €485

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Continuous Molecular Fields Approach Applied to Structure-Activity Modeling
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inferred← citeshttps://doi.org/10.1007/s11306-013-0564-3openalex-snapshot
An analysis of a ‘community-driven’ reconstruction of the human metabolic network
inferred← citeshttps://doi.org/10.1007/s11306-014-0733-zopenalex-snapshot
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inferred← citeshttps://doi.org/10.1016/j.bmc.2004.07.049openalex-snapshot
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inferred← citeshttps://doi.org/10.1016/j.bmc.2005.10.020openalex-snapshot
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inferred← citeshttps://doi.org/10.1016/j.ccr.2008.04.017openalex-snapshot
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The central role of chemoinformatics
inferred← citeshttps://doi.org/10.1016/j.chemolab.2011.05.013openalex-snapshot
Redundancy analysis for characterizing the correlation between groups of variables - Applied to molecular descriptors
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Targeted QSPR for the prediction of the laminar burning velocity of biofuels
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Novel topological reverse indices and entropies of armchair versus zigzag polyhex carbon nanotubes with spectroscopic applications
inferred← citeshttps://doi.org/10.1016/j.cplett.2005.11.091openalex-snapshot
Novel 2-D graphical representation of proteins
inferred← citeshttps://doi.org/10.1016/j.cplett.2007.04.037openalex-snapshot
2-D Graphical representation of proteins based on physico-chemical properties of amino acids
inferred← citeshttps://doi.org/10.1016/j.ddtec.2010.10.003openalex-snapshot
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inferred← citeshttps://doi.org/10.1016/j.drudis.2006.10.004openalex-snapshot
Systems biology, metabolic modelling and metabolomics in drug discovery and development
inferred← citeshttps://doi.org/10.1016/j.drudis.2012.11.008openalex-snapshot
The promiscuous binding of pharmaceutical drugs and their transporter-mediated uptake into cells: what we (need to) know and how we can do so
inferred← citeshttps://doi.org/10.1016/j.entcs.2005.06.040openalex-snapshot
From Chemical Rules to Term Rewriting
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inferred← citeshttps://doi.org/10.1016/j.molstruc.2010.02.006openalex-snapshot
3D visualization of molecular structures in the MOGADOC database
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inferred← citeshttps://doi.org/10.1016/j.theochem.2009.09.011openalex-snapshot
Molecular structure, lipophilicity, solubility, absorption, and polar surface area of novel anticoagulant agents
inferred← citeshttps://doi.org/10.1016/j.theochem.2009.12.017openalex-snapshot
Molecular structure, pK, lipophilicity, solubility and absorption of biologically active aromatic and heterocyclic sulfonamides
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Event extraction for systems biology by text mining the literature
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Web-based cheminformatics tools deployed via corporate Intranets
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Machine Learning Methods for Property Prediction in Chemoinformatics:Quo Vadis?
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Johann Gasteiger − Germany's Pioneer in Chemoinformatics
inferred← citeshttps://doi.org/10.1021/ja401184gopenalex-snapshot
Stochastic Voyages into Uncharted Chemical Space Produce a Representative Library of All Possible Drug-Like Compounds
inferred← citeshttps://doi.org/10.1038/nbt.1973openalex-snapshot
Shaping the future of safer innovative drugs in Europe
inferred← citeshttps://doi.org/10.1038/nrd2438openalex-snapshot
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Improved residue contact prediction using support vector machines and a large feature set
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Using Pareto points for model identification in predictive toxicology
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Random forests for feature selection in QSPR Models - an application for predicting standard enthalpy of formation of hydrocarbons
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A molecular fragment cheminformatics roadmap for mesoscopic simulation
inferred← citeshttps://doi.org/10.1186/s13321-017-0198-yopenalex-snapshot
Analysis of drug–endogenous human metabolite similarities in terms of their maximum common substructures
inferred← citeshttps://doi.org/10.1371/journal.pcbi.1003400openalex-snapshot
Machine Learning Estimates of Natural Product Conformational Energies
inferred← citeshttps://doi.org/10.1517/17460441.2010.497534openalex-snapshot
De novodesign: balancing novelty and confined chemical space
inferred← citeshttps://doi.org/10.2152/jmi.52.297openalex-snapshot
Virtual screening models for finding novel antidepressants
inferred← citeshttps://doi.org/10.24927/rce2015.084openalex-snapshot
Redes Neuronais Artificiais
inferred← citeshttps://doi.org/10.31274/rtd-180813-8742openalex-snapshot
Design and development of GrainNet - universal Internet enabled software for operation and standardization of near-infrared spectrometers
inferred← citeshttps://doi.org/10.3390/mol2net-1-f013openalex-snapshot
SISTEMAT X - A web tool to manage databases of secondary metabolites
inferred← citeshttps://doi.org/10.48550/arxiv.1303.1724openalex-snapshot
Automated Identification and Classification of Stereochemistry: Chirality and Double Bond Stereoisomerism
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Chemical Similarity Networks for Drug Discovery
inferred← citeshttps://doi.org/10.5772/intechopen.89012openalex-snapshot
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Application of Information Science and Technology in Chemical Research
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