29 июл. 2022 г. · HTVS and SP docking use the same scoring function, but HTVS reduces the number of intermediate conformations throughout the docking funnel. |
The Glide HTVS is a high-throughput virtual screening (HTVS) software tool developed by Schrödinger. It is designed to rapidly evaluate large chemical ... |
Glide HTVS can dock compounds at a rate of about 2 seconds/compound and trades sampling breath for higher speeds. Glide SP performs exhaustive sampling and is ... |
Glide HTVS can dock compounds at a rate of about 2 seconds/compound and trades sampling breath for higher speeds. · Glide SP performs exhaustive sampling and is ... |
HTVS selected 16,747 compounds based on Glide score. SP docking filtered by another Glide score criteria value (Glide score < -4.0 Kcal/mol) which led to 249 ... |
Оценка 86 %  (1) Glide High Throughput Virtual Screening Htvs Docking Module, supplied by Chembridge, used in various techniques. Bioz Stars score: 86/100, based on 1 PubMed ... |
6 февр. 2023 г. · This dataset is composed of two sets of docking results for the 1.56 billion compounds of the Enamine REAL (ER) lead-like library (obtained ... |
Glide HTVS ( Table S1) generally achieved poorly fitting poses, the only exception being for the semagacestat docked to the cognate structure (PDB 6LR4). ... |
Our technology combines high-throughput virtual screening (HTVS) of compound libraries, molecular docking, and single-molecule atomic force spectroscopy (smAFS) ... |
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