Mordred: a molecular descriptor calculator

Hirotomo Moriwaki; Yu‐Shi Tian; Norihito Kawashita; Tatsuya Takagi

doi:10.1186/s13321-018-0258-y

Keywords

Computer scienceCheminformaticsPython (programming language)SoftwareCalculatorData miningFlexibility (engineering)Software packageMolecular descriptorSoftware engineeringComputational scienceMachine learningBioinformaticsOperating systemQuantitative structure–activity relationshipMathematics

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Publication Info

Year: 2018
Type: article
Volume: 10
Issue: 1
Pages: 4-4
Citations: 1351
Access: Closed

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APA Style

                            
                                
                                    Hirotomo Moriwaki, 
                                
                                    Yu‐Shi Tian, 
                                
                                    Norihito Kawashita
                                
                                et al.
                            
                            (2018). 
                            Mordred: a molecular descriptor calculator. 
                            Journal of Cheminformatics
                            , 10
                            (1)
                            , 4-4.
                            https://doi.org/10.1186/s13321-018-0258-y
                        

Identifiers

DOI: 10.1186/s13321-018-0258-y