bioexcel / biobb_chemistry

Biobb_chemistry is the Biobb module collection to perform chemistry over molecular dynamics simulations.
https://mmb.irbbarcelona.org/biobb/
Apache License 2.0
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AcpypeParamsGMX not working without properties basename defined #1

Closed adamhospital closed 4 years ago

adamhospital commented 4 years ago

AcpypeParamsGMX is not properly working if the 'basename' property is not defined. For example, if run without properties (basename by default), the output files are not generated.