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Assessment of Docking Poses: Interactions-Based Accuracy Classification (IBAC) versus Crystal Structure Deviations

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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

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Modifications of the scoring function in FlexX for virtual screening applications
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Indirubin, the active constituent of a Chinese antileukaemia medicine, inhibits cyclin-dependent kinases
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Protein kinase inhibition by staurosporine revealed in details of the molecular interaction with CDK2
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The Protein Data Bank
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Prevention of Chemotherapy-Induced Alopecia in Rats by CDK Inhibitors

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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Assessment of Docking Poses: Interactions‐Based Accuracy Classification (IBAC) versus Crystal Structure Deviations.
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Scoring Functions of Protein-Ligand Interactions
inferred← citeshttps://doi.org/10.4018/978-1-5225-0549-5.ch036openalex-snapshot
Scoring Functions of Protein-Ligand Interactions
inferred← citeshttps://doi.org/10.4155/fmc.11.18openalex-snapshot
Integrating Structure-Based and Ligand-Based Approaches for Computational Drug Design
inferred← citeshttps://doi.org/10.70675/de51bc89z33fez456fz9467z959329cc603bopenalex-snapshot
Optimisation de méthodes de criblage virtuel et synthèse de molécules à visée thérapeutique pour le traitement des maladies auto-immunes.
inferred← citeshttps://doi.org/10.7287/peerj.13374v0.1/reviews/1openalex-snapshot
Peer Review #1 of "Withasomniferol C, a new potential SARS-CoV-2 main protease inhibitor from the Withania somnifera plant proposed by in silico approaches (v0.1)"
inferred← citeshttps://doi.org/10.7287/peerj.13374v0.1/reviews/2openalex-snapshot
Peer Review #2 of "Withasomniferol C, a new potential SARS-CoV-2 main protease inhibitor from the Withania somnifera plant proposed by in silico approaches (v0.1)"
inferred← citeshttps://doi.org/10.7287/peerj.13374v0.2/reviews/1openalex-snapshot
Peer Review #1 of "Withasomniferol C, a new potential SARS-CoV-2 main protease inhibitor from the Withania somnifera plant proposed by in silico approaches (v0.2)"
inferred← citeshttps://doi.org/10.7287/peerj.13374v0.2/reviews/2openalex-snapshot
Peer Review #2 of "Withasomniferol C, a new potential SARS-CoV-2 main protease inhibitor from the Withania somnifera plant proposed by in silico approaches (v0.2)"
inferred← citeshttps://doi.org/10.7717/peerj.13374openalex-snapshot
Withasomniferol C, a new potential SARS-CoV-2 main protease inhibitor from the Withania somnifera plant proposed by in silico approaches
inferred← citeshttps://doi.org/10.7763/ijbbb.2014.v4.319openalex-snapshot
Comparison of AutoDock and Glide towards the Discovery of PPAR Agonists
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.