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Open Computing Grid for Molecular Science and Engineering
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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/(sici)1096-987x(19981115)19:14<1639::aid-jcc10>3.0.co;2-bopenalex-snapshot
Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function
inferredcites →https://doi.org/10.1002/jcc.540130311openalex-snapshot
Molecular docking using shape descriptors
inferredcites →https://doi.org/10.1002/jcc.540141112openalex-snapshot
General atomic and molecular electronic structure system
inferredcites →https://doi.org/10.1006/jcph.1999.6201openalex-snapshot
NAMD2: Greater Scalability for Parallel Molecular Dynamics
inferredcites →https://doi.org/10.1006/jmbi.1996.0477openalex-snapshot
A Fast Flexible Docking Method using an Incremental Construction Algorithm
inferredcites →https://doi.org/10.1007/11508380_48openalex-snapshot
OpenMolGRID: Using Automated Workflows in GRID Computing Environment
inferredcites →https://doi.org/10.1007/3-540-45545-0_65openalex-snapshot
Supporting Car-Parrinello Molecular Dynamics with UNICORE
inferredcites →https://doi.org/10.1007/b137919openalex-snapshot
Advances in Grid Computing - EGC 2005
inferredcites →https://doi.org/10.1016/0263-7855(94)00002-aopenalex-snapshot
QMView: A computational chemistry three-dimensional visualization tool at the interface between molecules and mankind
inferredcites →https://doi.org/10.1016/0263-7855(96)00018-5openalex-snapshot
VMD: Visual molecular dynamics
inferredcites →https://doi.org/10.1016/j.future.2004.09.010openalex-snapshot
Application of grid computing to parameter sweeps and optimizations in molecular modeling
inferredcites →https://doi.org/10.1016/j.future.2004.09.027openalex-snapshot
Incorporation of middleware and grid technologies to enhance usability in Computational Chemistry applications
inferredcites →https://doi.org/10.1016/j.jmgm.2004.03.007openalex-snapshot
Combating bioterrorism with personal computers
inferredcites →https://doi.org/10.1016/j.parco.2004.07.009openalex-snapshot
Grid-enabled data warehousing for molecular engineering
inferredcites →https://doi.org/10.1016/s0743-7315(03)00005-4openalex-snapshot
EUROGRID—European computational grid testbed
inferredcites →https://doi.org/10.1016/s0743-7315(03)00006-6openalex-snapshot
Entropia: architecture and performance of an enterprise desktop grid system
inferredcites →https://doi.org/10.1016/s1093-3263(02)00164-xopenalex-snapshot
LigandFit: a novel method for the shape-directed rapid docking of ligands to protein active sites
inferredcites →https://doi.org/10.1021/ci00011a015openalex-snapshot
Rapid conversion of molecular graphs to three-dimensional representation using the MOLGEO program
inferredcites →https://doi.org/10.1021/ci990052bopenalex-snapshot
Chemical Markup, XML, and the Worldwide Web. 1. Basic Principles
inferredcites →https://doi.org/10.1021/cr950202ropenalex-snapshot
Quantum-Chemical Descriptors in QSAR/QSPR Studies
inferredcites →https://doi.org/10.1038/nrd841openalex-snapshot
Virtual screening using grid computing: the screensaver project
inferredcites →https://doi.org/10.1145/1084805.1084816openalex-snapshot
Scheduling of scientific workflows in the ASKALON grid environment
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.1002/jps.21293openalex-snapshot
Current topics in computer‐aided drug design
inferred← citeshttps://doi.org/10.1002/minf.201600082openalex-snapshot
Public (Q)SAR Services, Integrated Modeling Environments, and Model Repositories on the Web: State of the Art and Perspectives for Future Development
inferred← citeshttps://doi.org/10.1002/qsar.200710119openalex-snapshot
The Integrated Use of Models for the Properties and Effects of Chemicals by means of a Structured Workflow
inferred← citeshttps://doi.org/10.1002/qsar.200810174openalex-snapshot
Docking and Virtual Screening Using Distributed Grid Technology
inferred← citeshttps://doi.org/10.1007/978-3-540-69968-2_6openalex-snapshot
Grid Computing for the Estimation of Toxicity: Acute Toxicity on Fathead Minnow (Pimephales promelas)
inferred← citeshttps://doi.org/10.1007/978-3-540-75755-9_37openalex-snapshot
Supporting SLA Negotiation for QoS-Enabled Simulation Services in a Medical Grid Environment
inferred← citeshttps://doi.org/10.1007/978-3-540-78474-6_12openalex-snapshot
Chemomentum - UNICORE 6 Based Infrastructure for Complex Applications in Science and Technology
inferred← citeshttps://doi.org/10.1007/978-3-642-02193-0_2openalex-snapshot
Towards Bioinformatics Resourceomes
inferred← citeshttps://doi.org/10.1007/978-981-99-6637-0_12openalex-snapshot
Recent Developments in the Application of Computer-Aided Drug Design in Neurodegenerative Disorders
inferred← citeshttps://doi.org/10.1007/s00354-007-0023-7openalex-snapshot
End-to-End QoS Support for a Medical Grid Service Infrastructure
inferred← citeshttps://doi.org/10.1007/s10723-007-9080-xopenalex-snapshot
Quality of Service Negotiation for Commercial Medical Grid Services
inferred← citeshttps://doi.org/10.1016/b978-0-32-390865-8.00032-5openalex-snapshot
Towards open molecular science
inferred← citeshttps://doi.org/10.1016/j.chemosphere.2014.12.001openalex-snapshot
In silico prediction of chemical toxicity on avian species using chemical category approaches
inferred← citeshttps://doi.org/10.1016/j.compchemeng.2008.07.007openalex-snapshot
A decision support grid for integrated molecular solvent design and chemical process selection
inferred← citeshttps://doi.org/10.1016/j.drudis.2008.03.006openalex-snapshot
Grid computing in large pharmaceutical molecular modeling
inferred← citeshttps://doi.org/10.1016/j.future.2006.04.018openalex-snapshot
Mining of the chemical information in GRID environment
inferred← citeshttps://doi.org/10.1016/j.procs.2010.04.131openalex-snapshot
Theoretical enzyme design using the Kepler scientific workflows on the Grid
inferred← citeshttps://doi.org/10.1016/j.procs.2013.05.274openalex-snapshot
A Service-oriented Framework for Integration of Domain-specific Data Models in Scientific Workflows
inferred← citeshttps://doi.org/10.1021/cc800183mopenalex-snapshot
Distributed Drug Discovery, Part 1: Linking Academia and Combinatorial Chemistry to Find Drug Leads for Developing World Diseases
inferred← citeshttps://doi.org/10.1021/ci700231copenalex-snapshot
Modeling the Toxicity of Chemicals toTetrahymenapyriformisUsing Heuristic Multilinear Regression and Heuristic Back-Propagation Neural Networks
inferred← citeshttps://doi.org/10.1021/ci700334fopenalex-snapshot
Distributed Chemical Computing Using ChemStar: An Open Source Java Remote Method Invocation Architecture Applied to Large Scale Molecular Data from PubChem
inferred← citeshttps://doi.org/10.1021/ci800263copenalex-snapshot
Open Science Grid Study of the Coupling between Conformation and Water Content in the Interior of a Protein
inferred← citeshttps://doi.org/10.1080/1062936x.2010.528596openalex-snapshot
QSAR model for the prediction of bio-concentration factor using aqueous solubility and descriptors considering various electronic effects
inferred← citeshttps://doi.org/10.1080/1062936x.2012.762426openalex-snapshot
Comparative analysis of local and consensus quantitative structure-activity relationship approaches for the prediction of bioconcentration factor
inferred← citeshttps://doi.org/10.1080/17460441.2019.1552936openalex-snapshot
Advances in distributed computing with modern drug discovery
inferred← citeshttps://doi.org/10.1109/tnb.2007.897492openalex-snapshot
An Agent-Based Multilayer Architecture for Bioinformatics Grids
inferred← citeshttps://doi.org/10.1186/1758-2946-6-25openalex-snapshot
QSAR DataBank - an approach for the digital organization and archiving of QSAR model information
inferred← citeshttps://doi.org/10.1186/s13321-021-00509-zopenalex-snapshot
Flame: an open source framework for model development, hosting, and usage in production environments
inferred← citeshttps://doi.org/10.1289/ehp3264openalex-snapshot
Best Practices for QSAR Model Reporting: Physical and Chemical Properties, Ecotoxicity, Environmental Fate, Human Health, and Toxicokinetics Endpoints
inferred← citeshttps://doi.org/10.2147/oab.s7272openalex-snapshot
Efficiency of a hierarchical protocol for high throughput structure-based virtual screening on GRID5000 cluster grid
inferred← citeshttps://doi.org/10.4236/cn.2012.41005openalex-snapshot
NAMD Package Benchmarking on the Base of Armenian Grid Infrastructure
inferred← citeshttps://doi.org/10.47749/t/unicamp.2008.434145openalex-snapshot
Uma ferramenta para monitoramento do sistema JoiN de processamento maciçamente paralelo virtual
inferred← citeshttps://doi.org/10.53846/goediss-6055openalex-snapshot
Interoperable Information Exchange, Resource Discovery, and Service Quality Monitoring Across Virtual Organizations in Distributed Research Infrastructures
inferred← citeshttps://doi.org/10.6084/m9.figshare.14450922openalex-snapshot
Additional file 2 of Flame: an open source framework for model development, hosting, and usage in production environments
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Science and Advanced Computing — runs a structured editorial panel for researchers
publishing outside journals, and publishes on CiteStamp rails. Submission is free
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