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Structural and Computational-Driven Molecule Design in Drug Discovery

Structural and Computational-Driven Molecule Design in Drug Discovery

Hardback (07 May 2024)

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Publisher's Synopsis

This Special Issue aimed to provide deep mechanistic insights into strategies in structural dynamics studies and computational methods. The areas of research included but were not limited to the following: structural dynamics studies, computer-aided drug designs, molecular dynamic simulations, molecular docking, virtual screening, QSAR, and in silico ADMET analyses.

Book information

ISBN: 9783725810147
Publisher: Mdpi AG
Imprint: Mdpi AG
Pub date:
Language: English
Number of pages: 468
Weight: 1202g
Height: 244mm
Width: 170mm
Spine width: 37mm