Biocview "Cheminformatics"

Accelerated similarity searching of small molecules

Automated spectraL Processing System for NMR

Automatic Statistical Identification in Complex Spectra

Cell birth and death rates estimation

Cheminformatics Toolkit for R

Clonogenic Survival Analysis in R made easy!

Code for using BridgeDb identifier mapping framework from within R

Customize and Query Compound Annotation Database

Cutsomize and Query Compound Annotation Database

Data normalization by matrix raking

Drug-Target Interactions

Generating Various Molecular Representations for Chemicals, Proteins, DNAs, RNAs and Their Interactions

Generating Various Molecular Representations for Chemicals, Proteins, DNAs/RNAs and Their Interactions

Hammett-Taft type sigma descriptor calculator

Linear Models for Microarray Data

Metabolomic Quantitative Trait Locus Mapping for 1H NMR data

Mismatch Tolerant Maximum Common Substructure Searching

Molecular Informatics Toolkit for Compound-Protein Interaction in Drug Discovery

MWASTools: an integrated pipeline to perform metabolome-wide association studies

Perform co-DE gene analysis

Preprocessing of spectra data from high resolution mass spectrometry

rcellminer: Molecular Profiles, Drug Response, and Chemical Structures for the NCI-60 Cell Lines

R interface to a subset of OpenBabel functionalities

R Interface to MELTING 5

R package for mass and molecular formula calculations

Tools for Manipulating the FOBI Ontology

Viz tool for xcms peak picking parameter optimisation