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Application

Discovery Studio 1.0 Materials Studio 0.012708498808578236 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.003965107057890563 CASTEP 0.0015860428231562252 CDOCKER 0.24107850911974624 CHARMm 0.41395717684377475 COMPASS 0.0023790642347343376 COMPASS III 0.0031720856463124504 COSMOtherm 0.0015860428231562252 Catalyst 0.13005551149881048 Classical Simulations 0.4274385408406027 Crystallization 0.0023790642347343376 DMol3 0.008723235527359239 Forcite 0.007137192704203013 LUDI 0.006344171292624901 LibDock 0.10547184773988898 LigandFit 0.0023790642347343376 MODELER 0.3687549563838224 Polymorph 0.0 QSAR 0.0 Quantum Mechanics 0.011102299762093577 Reflex 0.0015860428231562252 Sorption 7.930214115781126E-4 Visualization 1.0 X-Cell 7.930214115781126E-4 ZDOCK 0.03330689928628073

Year

2024 0.13979496738117428 2025 1.0 2026 0.0

Keywords

docking 1.0 target 0.95751953125 potential 0.5712890625 analysis 0.39453125 visualization 0.37109375 binding 0.3359375 activity 0.16357421875 novel 0.138671875 protein 0.125 promising 0.1240234375 silico 0.12060546875 therapeutic 0.11865234375 vitro 0.08984375 inhibition 0.080078125 compound 0.072265625 between 0.06396484375 including 0.05810546875 strong 0.0517578125 interaction 0.03759765625 drug 0.0322265625 synthesis 0.029296875 synthesized 0.02392578125 stability 0.017578125 treatment 0.009765625 development 0.0
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