Work

Fast energy minimization of the CCDC drug-subset structures by molecule-in-cluster computations allows independent structure validation and model completion

Year: 2020

Type: article

Source: CrystEngComm

DOI: 10.1039/d0ce00488j

Authors: Birger Dittrich, Stephen Chan, Seth Wiggin, Joanna S. Stevens, Elna Pidcock

Institutions: Novartis (Switzerland), Cambridge Crystallographic Data Centre

Language: English

Topic: Crystal structures of chemical compounds

Subfield: Inorganic Chemistry

Field: Chemistry

Domain: Physical Sciences

Open Access status: closed

OpenAlex ID: W3043801498

FWCI: 0.621

Cites: 93

Cited by: 11

Related to: 10