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The ROBIA Program for Predicting Organic Reactivity
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1002/0470845015openalex-snapshot
Encyclopedia of Computational Chemistry
inferredcites →https://doi.org/10.1002/jcc.540110405openalex-snapshot
Macromodel—an integrated software system for modeling organic and bioorganic molecules using molecular mechanics
inferredcites →https://doi.org/10.1016/0040-4020(96)00764-8openalex-snapshot
Dolabriferol: A new polypropionate from the skin of the anaspidean mollusc Dolabrifera dolabrifera
inferredcites →https://doi.org/10.1021/ci00010a019openalex-snapshot
Reaction prediction: the suggestions of the Beppe program
inferredcites →https://doi.org/10.1021/ci034078lopenalex-snapshot
Predicting Biotransformation Potential from Molecular Structure
inferredcites →https://doi.org/10.1021/ci950058aopenalex-snapshot
Further Development of a Reaction Generator in the SOPHIA System for Organic Reaction Prediction. Knowledge-Guided Addition of Suitable Atoms and/or Atomic Groups to Product Skeleton
inferredcites →https://doi.org/10.1021/ci990433popenalex-snapshot
Simulation of Organic Reactions: From the Degradation of Chemicals to Combinatorial Synthesis
inferredcites →https://doi.org/10.1021/cr00023a012openalex-snapshot
From atoms and bonds to three-dimensional atomic coordinates: automatic model builders
inferredcites →https://doi.org/10.1021/ja00038a052openalex-snapshot
Empirical force field models for the transition states of intramolecular Diels-Alder reactions based upon ab initio transition structures
inferredcites →https://doi.org/10.1021/ja00216a065openalex-snapshot
Macroring contraction methodology. 4. A novel route to steroid A, B, C rings by the transannular Diels-Alder reaction of the 14-membered (E,E,E)-macrocyclic triene
inferredcites →https://doi.org/10.1021/ja00216a066openalex-snapshot
Fischer carbene-mediated conversions of enynes to bi- and tricyclic cyclopropane-containing carbon skeletons
inferredcites →https://doi.org/10.1021/ol0512738openalex-snapshot
ROBIA: A Reaction Prediction Program
inferredcites →https://doi.org/10.1351/pac196714010019openalex-snapshot
General methods for the construction of complex molecules
inferredcites →https://doi.org/10.1351/pac199062101921openalex-snapshot
CAMEO: a program for the logical prediction of the products of organic reactions
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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Mutagenic Impurities – Assessment of Fate and Control Options
inferred← citeshttps://doi.org/10.1002/9783527645121.ch15openalex-snapshot
Generation of Chemical Transformations: Reaction Pathways Prediction and Synthesis Design
inferred← citeshttps://doi.org/10.1002/9783527806539.ch4bopenalex-snapshot
Reaction Prediction and Synthesis Design
inferred← citeshttps://doi.org/10.1002/ajoc.202000255openalex-snapshot
Synthesis of C1−C9 and C10−C21 Fragments of (−)‐Dolabriferol
inferred← citeshttps://doi.org/10.1002/ange.201003735openalex-snapshot
Totalsynthese und Bestimmung der absoluten Konfiguration von (−)‐Dolabriferol
inferred← citeshttps://doi.org/10.1002/ange.201109080openalex-snapshot
In Silico Inspired Total Synthesis of (−)‐Dolabriferol
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Computergestützte Syntheseplanung: Das Ende vom Anfang
inferred← citeshttps://doi.org/10.1002/anie.201003735openalex-snapshot
Total Synthesis and Determination of the Absolute Configuration of (−)‐Dolabriferol
inferred← citeshttps://doi.org/10.1002/anie.201109080openalex-snapshot
In Silico Inspired Total Synthesis of (−)‐Dolabriferol
inferred← citeshttps://doi.org/10.1002/anie.201506101openalex-snapshot
Computer‐Assisted Synthetic Planning: The End of the Beginning
inferred← citeshttps://doi.org/10.1002/ejoc.201701748openalex-snapshot
Stereoselective Total Synthesis of the Non‐Contiguous Polyketide Natural Product (–)‐Dolabriferol
inferred← citeshttps://doi.org/10.1002/wcms.61openalex-snapshot
Computer‐aided synthesis design: 40 years on
inferred← citeshttps://doi.org/10.1007/978-81-322-1780-0_6openalex-snapshot
Representation, Fingerprinting, and Modelling of Chemical Reactions
inferred← citeshttps://doi.org/10.1007/s10822-007-9120-4openalex-snapshot
Computational assessment of synthetic procedures
inferred← citeshttps://doi.org/10.1016/j.ddtec.2013.01.005openalex-snapshot
Data-driven computer aided synthesis design
inferred← citeshttps://doi.org/10.1021/acs.oprd.9b00358openalex-snapshot
New Semi-Automated Computer-Based System for Assessing the Purge of Mutagenic Impurities
inferred← citeshttps://doi.org/10.1021/ci100146nopenalex-snapshot
Search for Complexity Generating Chemical Transformations by Combining Connectivity Analysis and Cascade Transformation Patterns
inferred← citeshttps://doi.org/10.1021/ci800228yopenalex-snapshot
Route Designer: A Retrosynthetic Analysis Tool Utilizing Automated Retrosynthetic Rule Generation
inferred← citeshttps://doi.org/10.1021/mp400083hopenalex-snapshot
An Expert System To Predict the Forced Degradation of Organic Molecules
inferred← citeshttps://doi.org/10.1038/nature25978openalex-snapshot
Planning chemical syntheses with deep neural networks and symbolic AI
inferred← citeshttps://doi.org/10.1038/s41597-020-00727-4openalex-snapshot
SAVI, in silico generation of billions of easily synthesizable compounds through expert-system type rules
inferred← citeshttps://doi.org/10.1039/c8cc09344jopenalex-snapshot
BINOPtimal: a web tool for optimal chiral phosphoric acid catalyst selection
inferred← citeshttps://doi.org/10.1039/d6cs00079gopenalex-snapshot
An overview of reaction outcome prediction with physics-based and data-driven methods
inferred← citeshttps://doi.org/10.1246/bcsj.20200017openalex-snapshot
Quantum Chemical Reaction Prediction Method Based on Machine Learning
inferred← citeshttps://doi.org/10.26434/chemrxiv.12185559openalex-snapshot
Synthetically Accessible Virtual Inventory (SAVI)
inferred← citeshttps://doi.org/10.26434/chemrxiv.12185559.v1openalex-snapshot
Synthetically Accessible Virtual Inventory (SAVI)
inferred← citeshttps://doi.org/10.3389/fchem.2014.00026openalex-snapshot
Alternative methods of processing bio-feedstocks in formulated consumer product design
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LeadOp+R: Structure-Based Lead Optimization With Synthetic Accessibility
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