Web‐4D‐QSAR: A web‐based application to generate 4D‐QSAR descriptors
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DOI: 10.1002/jcc.25166
Abstract: A web‐based application is developed to generate 4D‐QSAR descriptors using the LQTA‐QSAR methodology, based on molecular dynamics (MD) trajectories and topology information retrieved from the GROMACS package. The LQTAGrid module calculates the intermolecular interaction energies… read more here.
Keywords: methodology; qsar descriptors; web based; qsar ... See more keywords