Evidence map›Paper›PMID 34251523›Full record

ArticleJournal of computer-aided molecular design2021

Multiple linear regression models for predicting the n‑octanol/water partition coefficients in the SAMPL7 blind challenge.

Kenneth Lopez, Silvana Pinheiro, William J Zamora

Abstract read
In one paragraph

Article in Journal of computer-aided molecular design, 2021. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 4 papers.

0numbers the graph read from it
0cells of the map it votes in
4citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

4 citing papers in PubMed.

  1. Article
  2. Article
  3. Article
  4. Evaluation of log P, pKJournal of computer-aided molecular design · 2021
    Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

3 authors.

Kenneth LopezSchool of Chemistry, University of Costa Rica, San Pedro, San José, Costa Rica.
Silvana PinheiroInstitute of Exact and Natural Sciences, Federal University of Pará, Belém, Pará, 66075-110, Brazil.
William J ZamoraSchool of Chemistry, University of Costa Rica, San Pedro, San José, Costa Rica. william.zamoraramirez@ucr.ac.cr.ORCID 0000-0003-4029-4528

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

A multiple linear regression model called MLR-3 is used for predicting the experimental n-octanol/water partition coefficient (log P

Indexed as

Computer SimulationModels, ChemicalQuantum TheoryThermodynamics1-OctanolLinear ModelsSolubilityWater1-OctanolWaterEmpirical methodsMultiple linear regressionn-Octanol/water partition coefficientsN-sulfonamidesSAMPL7 blind challenge

Identifiers

PMID34251523
PMCPMC8273033

What OpenQuestion holds

Textmetadata
Read underepoch 390

Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.