Evidence map›Paper›PMID 36099194›Full record

ArticleJournal of computational biology : a journal of computational molecular cell biology2022

RESISTOR: A New OSPREY Module to Predict Resistance Mutations.

Nathan Guerin, Teresa Kaserer, Bruce R Donald

Abstract read
In one paragraph

Article in Journal of computational biology : a journal of computational molecular cell biology, 2022. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 2 papers.

0numbers the graph read from it
0cells of the map it votes in
2citing 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

2 citing papers in PubMed.

  1. Article
  2. 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.

Nathan GuerinDepartment of Computer Science, Duke University, Durham, North Carolina, USA.ORCID 0000-0001-8378-7854
Teresa KasererInstitute of Pharmacy/Pharmaceutical Chemistry, University of Innsbruck, Innsbruck, Austria.
Bruce R DonaldDepartment of Computer Science, Duke University, Durham, North Carolina, USA.

Funding

Computational Structure-Based Protein DesignR01GM078031 · NIGMS · DUKE UNIVERSITY · PI DONALD, BRUCE R. · 2008 to 2021
$4.3M
Diversity Supplement: Computational and Experimental Studies of Protein Structure and DesignR35GM144042 · NIGMS · DUKE UNIVERSITY · PI Bruce R. Donald · 2022 to 2026
$3.2M
Deep Topological Sampling of Protein StructuresR01GM118543 · NIGMS · DUKE UNIVERSITY · PI DONALD, BRUCE R. · 2017 to 2020
$1.4M
NIGMS NIH HHS R01 GM078031NIGMS NIH HHS R01 GM118543NIGMS NIH HHS R35 GM144042
6 · The paper itself

Abstract

Computational, in silico prediction of resistance-conferring escape mutations could accelerate the design of therapeutics less prone to resistance. This article describes how to use the Resistor algorithm to predict escape mutations. Resistor employs Pareto optimization on four resistance-conferring criteria-positive and negative design, mutational probability, and hotspot cardinality-to assign a Pareto rank to each prospective mutant. It also predicts the mechanism of resistance, that is, whether a mutant ablates binding to a drug, strengthens binding to the endogenous ligand, or a combination of these two factors, and provides structural models of the mutants. Resistor is part of the free and open-source computational protein design software OSPREY.

Indexed as

AlgorithmsProteinsLigandsMutationProspective StudiesLigandsProteinscancermutationOSPREYParetoresistanceRESISTOR

Identifiers

PMID36099194
PMCPMC9807075

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.