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A Geodesic Framework for Analyzing Molecular Similarities
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
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Modern multidimensional scaling : theory and applications
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Modern Multidimensional Scaling
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A self-organizing principle for learning nonlinear manifolds
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A Nonlinear Mapping for Data Structure Analysis
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Mathematical Analysis of Ferrite Core Memory Arrays
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V. Adaptive Control Processes
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A Global Geometric Framework for Nonlinear Dimensionality Reduction
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Nonlinear Dimensionality Reduction by Locally Linear Embedding
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What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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Advanced Artificial Intelligence Methods Used in the Design of Pharmaceutical Agents
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MOLECULAR SIMILARITY ANALYSIS
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De NovoDesign: From Models to Molecules
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Fast and reliable analysis of molecular motion using proximity relations and dimensionality reduction
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Stochastic Proximity Embedding: A Simple, Fast and Scalable Algorithm for Solving the Distance Geometry Problem
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Some Trends in Chem(o)informatics
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Molecular Similarity Measures
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Introduction to Molecular Similarity and Chemical Space
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The principle of complementarity: chemical versus biological space
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Computational mapping tools for drug discovery
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Nonlinear dimensionality reduction and mapping of compound libraries for drug discovery
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QSAR design of triazolopyridine mGlu2 receptor positive allosteric modulators
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Radial Clustergrams: Visualizing the Aggregate Properties of Hierarchical Clusters
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Molecular Basis SetsA General Similarity-Based Approach for Representing Chemical Spaces
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Enhanced SAR Maps: Expanding the Data Rendering Capabilities of a Popular Medicinal Chemistry Tool
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Compound Library Design – Principles and Applications
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