Ecosyste.ms: Papers

An open API service providing mapping between scientific papers and software projects that are mentioned in them.
All mentions data is based on the CZI Software Mentions dataset.

Projects: pypi: chemprop

https://packages.ecosyste.ms/registries/pypi.org/packages/chemprop

Molecular Property Prediction with Message Passing Neural Networks
13 versions
Latest release: over 1 year ago
209,666 downloads last month

Papers Mentioning chemprop 3

10.1007/s10822-021-00405-6
Multitask machine learning models for predicting lipophilicity (logP) in the SAMPL7 challenge
Cited by: 9
Author(s): Eelke B. Lenselink, Pieter F. W. Stouten
Software Mentions: 4
Published: over 3 years ago
10.1186/s13065-021-00737-2
De novo design and bioactivity prediction of SARS-CoV-2 main protease inhibitors using recurrent neural network-based transfer learning
Cited by: 43
Author(s): Marcos V.S. Santana, Floriano Paes Silva
Software Mentions: 1
Published: almost 4 years ago
10.1186/s13321-021-00533-z
MLSolvA: solvation free energy prediction from pairwise atomistic interactions by machine learning
Cited by: 13
Author(s): Hyuntae Lim, YounJoon Jung
Software Mentions: 1
Published: over 3 years ago