On the public citation graph
Design of molecules from quantitative structure-activity relationship models. 1. Information transfer between path and vertex degree counts
0 signed · 54 inferred · view as graph
Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.
Is this your work? Sign in with ORCID and put your name on the
claims that are yours.
Reference health. See whether every reference in this work resolves to a
known work and none has been retracted — and get a dated CiteStamped
badge you can embed.
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.1002/(sici)1097-461x(1999)71:3<217::aid-qua1>3.0.co;2-copenalex-snapshot
Resistance distance in regular graphs
inferred← citeshttps://doi.org/10.1002/0471266949.bmc002openalex-snapshot
Recent Trends in Quantitative Structure‐Activity Relationships
inferred← citeshttps://doi.org/10.1002/9783527665143.ch05openalex-snapshot
Exploring Virtual Scaffold Spaces
inferred← citeshttps://doi.org/10.1002/aic.14112openalex-snapshot
Optimization‐based framework for computer‐aided molecular design
inferred← citeshttps://doi.org/10.1002/aic.690430514openalex-snapshot
Optimal molecular design under property prediction uncertainty
inferred← citeshttps://doi.org/10.1002/aic.690450415openalex-snapshot
Optimal design of solvent blends for environmental impact minimization
inferred← citeshttps://doi.org/10.1002/jcc.20931openalex-snapshot
Computational modeling of tetrahydroimidazo‐[4,5,1‐jk][1,4]‐benzodiazepinone derivatives: An atomistic drug design approach using Kier‐Hall electrotopological state (E‐state) indices
inferred← citeshttps://doi.org/10.1002/minf.201700030openalex-snapshot
Finding Chemical Structures Corresponding to a Set of Coordinates in Chemical Descriptor Space
inferred← citeshttps://doi.org/10.1002/minf.201900087openalex-snapshot
Inverse‐QSPR for de novo Design: A Review
inferred← citeshttps://doi.org/10.1002/qsar.19930120406openalex-snapshot
The Generation of Molecular Structures from a Graph‐Based QSAR Equation
inferred← citeshttps://doi.org/10.1002/qua.560560707openalex-snapshot
On characterization of the conformations of nine-membered rings
inferred← citeshttps://doi.org/10.1007/978-3-319-56850-8_2openalex-snapshot
The Use of Topological Indices in QSAR and QSPR Modeling
inferred← citeshttps://doi.org/10.1007/bf01372590openalex-snapshot
Modeling properties of biochemical compounds with connectivity terms
inferred← citeshttps://doi.org/10.1007/s10822-005-9007-1openalex-snapshot
Reverse engineering chemical structures from molecular descriptors: how many solutions?
inferred← citeshttps://doi.org/10.1007/s10822-005-9010-6openalex-snapshot
Can topological indices transmit information on properties but not on structures?
inferred← citeshttps://doi.org/10.1016/0003-2670(94)90044-2openalex-snapshot
Principles for structure generation of organic isomers from molecular formula
inferred← citeshttps://doi.org/10.1016/b978-0-12-409547-2.14703-1openalex-snapshot
Chemometrics for QSAR Modeling
inferred← citeshttps://doi.org/10.1016/b978-012213810-2/50012-8openalex-snapshot
Computer-Aided Molecular Design Using Neural Networks and Genetic Algorithms
inferred← citeshttps://doi.org/10.1016/b978-1-898563-76-1.50012-3openalex-snapshot
Mixed Higher-Order Connectivity-Pseudoconnectivity Terms
inferred← citeshttps://doi.org/10.1016/j.cherd.2016.10.014openalex-snapshot
Computer-aided molecular design: An introduction and review of tools, applications, and solution techniques
inferred← citeshttps://doi.org/10.1016/j.compchemeng.2004.10.008openalex-snapshot
Computer-aided molecular design using Tabu search
inferred← citeshttps://doi.org/10.1016/j.compchemeng.2010.07.009openalex-snapshot
Reverse problem formulation approach to molecular design using property operators based on signature descriptors
inferred← citeshttps://doi.org/10.1016/j.ijggc.2014.08.023openalex-snapshot
In silico design of solvents for carbon capture with simultaneous optimisation of operating conditions
inferred← citeshttps://doi.org/10.1016/j.jmgm.2003.10.002openalex-snapshot
The signature molecular descriptor
inferred← citeshttps://doi.org/10.1016/s0098-1354(00)00420-8openalex-snapshot
Integrated product engineering: a hybrid evolutionary framework
inferred← citeshttps://doi.org/10.1016/s0098-1354(97)00257-3openalex-snapshot
Optimization in product design with properties correlated with topological indices
inferred← citeshttps://doi.org/10.1016/s0166-1280(98)00108-0openalex-snapshot
Properties of molecular connectivity terms and physicochemical properties
inferred← citeshttps://doi.org/10.1016/s1093-3263(01)00097-3openalex-snapshot
Issues in representation of molecular structure
inferred← citeshttps://doi.org/10.1016/s1093-3263(01)00098-5openalex-snapshot
The connectivity index 25 years after
inferred← citeshttps://doi.org/10.1016/s1570-7946(03)80007-xopenalex-snapshot
Genetic Algorithms Based CAMD
inferred← citeshttps://doi.org/10.1021/acs.jcim.5b00628openalex-snapshot
Inverse QSPR/QSAR Analysis for Chemical Structure Generation (fromytox)
inferred← citeshttps://doi.org/10.1021/ci020346oopenalex-snapshot
The Signature Molecular Descriptor. 2. Enumerating Molecules from Their Extended Valence Sequences
inferred← citeshttps://doi.org/10.1021/ci200409xopenalex-snapshot
Machine Learning Methods for Property Prediction in Chemoinformatics:Quo Vadis?
inferred← citeshttps://doi.org/10.1021/ci3001748openalex-snapshot
Lattice Enumeration for Inverse Molecular Design Using the Signature Descriptor
inferred← citeshttps://doi.org/10.1021/ci900447zopenalex-snapshot
Branch-and-Bound Algorithms for Enumerating Treelike Chemical Graphs with Given Path Frequency Using Detachment-Cut
inferred← citeshttps://doi.org/10.1021/cr0004456openalex-snapshot
From Molecular Connectivity Indices to Semiempirical Connectivity Terms: Recent Trends in Graph Theoretical Descriptors
inferred← citeshttps://doi.org/10.1021/ie302516vopenalex-snapshot
A Novel Methodology for Property-Based Molecular Design Using Multiple Topological Indices
inferred← citeshttps://doi.org/10.1021/ie9000794openalex-snapshot
QSPR Flash Point Prediction of Solvents Using Topological Indices for Application in Computer Aided Molecular Design
inferred← citeshttps://doi.org/10.1021/jp961434copenalex-snapshot
Modeling with Special Descriptors Derived from a Medium-Sized Set of Connectivity Indices
inferred← citeshttps://doi.org/10.1080/10629360108035364openalex-snapshot
The Use of Hasse Diagrams as a Potential Approach for Inverse QSAR
inferred← citeshttps://doi.org/10.1080/10629369908039111openalex-snapshot
On Characterization of the CC Double Bond in Alkenes
inferred← citeshttps://doi.org/10.1080/10826076.2019.1590207openalex-snapshot
Chromatographic descriptors in QSAR study of barbiturates
inferred← citeshttps://doi.org/10.1145/3180382.3180384openalex-snapshot
Enumerating Chemical Mono-Block 3-Augmented Trees with Two Junctions
inferred← citeshttps://doi.org/10.1186/1758-2946-1-4openalex-snapshot
A constructive approach for discovering new drug leads: Using a kernel methodology for the inverse-QSAR problem
inferred← citeshttps://doi.org/10.1186/1758-2946-6-31openalex-snapshot
Efficient enumeration of monocyclic chemical graphs with given path frequencies
inferred← citeshttps://doi.org/10.12688/f1000research.12228.1openalex-snapshot
Exploring differential evolution for inverse QSAR analysis
inferred← citeshttps://doi.org/10.1587/transinf.e94.d.1846openalex-snapshot
Kernel Methods for Chemical Compounds: From Classification to Design
inferred← citeshttps://doi.org/10.22052/ijmc.2015.8944openalex-snapshot
Relationship between Topological Indices and Thermodynamic Properties and of the Monocarboxylic Acids Applications in QSPR
inferred← citeshttps://doi.org/10.3390/i8200456openalex-snapshot
Internal Test Sets Studies in a Group of Antimalarials
inferred← citeshttps://doi.org/10.5269/bspm.80247openalex-snapshot
QSPR Analysis with Curvilinear Regression Modeling and Temperature-Based Topological Indices
inferred← citeshttps://doi.org/10.5936/csbj.201302004openalex-snapshot
COMPARISON AND ENUMERATION OF CHEMICAL GRAPHS
inferred← citeshttps://doi.org/10.7251/comen2002077aopenalex-snapshot
STUDY OF THE BIOLOGICAL ACTIVITY DESCRIPTORS OF THE BARBITURIC ACID DERIVATIVES
Editorial review for independent work. ICSAC — the Institute for Complexity
Science and Advanced Computing — runs a structured editorial panel for researchers
publishing outside journals, and publishes on CiteStamp rails. Submission is free
and goes through ORCID: icsacinstitute.org/submit.