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Journal of Chemical Information and Modeling

Resumen/Descripción – provisto por la editorial

No disponible.

Palabras clave – provistas por la editorial

No disponibles.

Disponibilidad
Institución detectada Período Navegá Descargá Solicitá
No detectada desde ene. 2005 / hasta dic. 2023 ACS Publications

Información

Tipo de recurso:

revistas

ISSN impreso

1549-9596

ISSN electrónico

1549-960X

Editor responsable

American Chemical Society (ACS)

País de edición

Estados Unidos

Fecha de publicación

Tabla de contenidos

Prioritizing Virtual Screening with Interpretable Interaction Fingerprints

Alexandre V. FassioORCID; Laura ShubORCID; Luca PonzoniORCID; Jessica McKinleyORCID; Matthew J. O’MearaORCID; Rafaela S. Ferreira; Michael J. KeiserORCID; Raquel C. de Melo MinardiORCID

Palabras clave: Library and Information Sciences; Computer Science Applications; General Chemical Engineering; General Chemistry.

Pp. 4300-4318

MILCDock: Machine Learning Enhanced Consensus Docking for Virtual Screening in Drug Discovery

Connor J. Morris; Jacob A. Stern; Brenden Stark; Max Christopherson; Dennis Della CorteORCID

Palabras clave: Library and Information Sciences; Computer Science Applications; General Chemical Engineering; General Chemistry.

Pp. 5342-5350

Multitask Deep Neural Networks for Ames Mutagenicity Prediction

María Jimena MartínezORCID; María Virginia SabandoORCID; Axel J. SotoORCID; Carlos RocaORCID; Carlos Requena-Triguero; Nuria E. CampilloORCID; Juan A. Páez; Ignacio PonzoniORCID

Palabras clave: Library and Information Sciences; Computer Science Applications; General Chemical Engineering; General Chemistry.

Pp. 6342-6351

The Impact of Supervised Learning Methods in Ultralarge High-Throughput Docking

Claudio N. CavasottoORCID; Juan I. Di Filippo

Palabras clave: Library and Information Sciences; Computer Science Applications; General Chemical Engineering; General Chemistry.

Pp. No disponible

Excito-repellent and Pesticide-Likeness Properties of Essential Oils on Carpophilus dimidiatus (Fabricius) (Nitidulidae) and Oryzaephilus mercator (L.) (Silvanidae)

Nieves C. ComelliORCID; Patricia A. Diez; María R. Rodríguez; Gabriel O. Denett; Tamara E. López; Daniela M. Bracamonte; Erlinda V. Ortiz; Diego A. SampietroORCID; Pablo R. Duchowicz

Palabras clave: Library and Information Sciences; Computer Science Applications; General Chemical Engineering; General Chemistry.

Pp. No disponible