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• W4236137384 abstract "Abstract Invited for this month's cover is the group of Prof. Pavel Hobza, Czech Academy of Sciences, Prague. The cover picture shows a powerful automated quantum mechanics based SQM/COSMO approach to protein–ligand scoring. It comprises thorough preparation of ligand structures, extensive generation of binding complexes, fast geometry relaxation and reliable affinity prediction. Read the full text of the Minireview at 10.1002/cplu.202000120 ." @default.
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• W4236137384 date "2020-09-28" @default.
• W4236137384 modified "2023-10-01" @default.
• W4236137384 title "SQM/COSMO Scoring Function: Reliable Quantum‐Mechanical Tool for Sampling and Ranking in Structure‐Based Drug Design" @default.
• W4236137384 doi "https://doi.org/10.1002/cplu.202000627" @default.
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