4.6 Editorial Material

What is the role of cheminformatics in a pandemic?

Related references

Note: Only part of the references are listed.
Article Biochemistry & Molecular Biology

LitCovid: an open database of COVID-19 literature

Qingyu Chen et al.

Summary: Since the outbreak of the COVID-19 pandemic in 2020, there has been a significant increase in articles related to COVID-19 and SARS-CoV-2. LitCovid, as the first COVID-19-specific literature resource, provides freely accessible curated articles and information, and has been widely used by users globally.

NUCLEIC ACIDS RESEARCH (2021)

Letter Chemistry, Multidisciplinary

Crowdsourcing drug discovery for pandemics

John Chodera et al.

NATURE CHEMISTRY (2020)

Editorial Material Chemistry, Medicinal

COVID19-Computational Chemists Meet the Moment

Adrian J. Mulholland et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2020)

Article Computer Science, Information Systems

Taking FAIR on the ChIN: The Chemistry Implementation Network

Simon J. Coles et al.

DATA INTELLIGENCE (2020)

Article Biochemistry & Molecular Biology

ChEMBL: towards direct deposition of bioassay data

David Mendez et al.

NUCLEIC ACIDS RESEARCH (2019)

Editorial Material Chemistry, Multidisciplinary

Helping to improve the practice of cheminformatics

Rajarshi Guha et al.

JOURNAL OF CHEMINFORMATICS (2017)

Article Biochemistry & Molecular Biology

Confidence limits, error bars and method comparison in molecular modeling. Part 2: comparing methods

A. Nicholls

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN (2016)

Article Multidisciplinary Sciences

Comment: The FAIR Guiding Principles for scientific data management and stewardship

Mark D. Wilkinson et al.

SCIENTIFIC DATA (2016)

Article Biochemistry & Molecular Biology

The statistics of virtual screening and lead optimization

Mark McGann et al.

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN (2015)

Article Biochemistry & Molecular Biology

Confidence limits, error bars and method comparison in molecular modeling. Part 1: The calculation of confidence intervals

A. Nicholls

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN (2014)

Article Chemistry, Medicinal

Trust, But Verify: On the Importance of Chemical Structure Curation in Cheminformatics and QSAR Modeling Research

Denis Fourches et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2010)

Review Chemistry, Medicinal

Best Practices for QSAR Model Development, Validation, and Exploitation

Alexander Tropsha

MOLECULAR INFORMATICS (2010)