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Application

Discovery Studio 1.0 Materials Studio 0.14822247706422018 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.023474178403755867 Amorphous Cell 0.030777256129368807 Blends 0.0 CASTEP 0.15127803860198227 CDOCKER 0.2571726656233698 CHARMm 0.3541992696922274 COMPASS 0.05372978612415232 COMPASS III 0.008868022952529996 COSMOconf 0.001564945226917058 COSMOperm 5.216484089723526E-4 COSMOtherm 0.015127803860198226 Catalyst 0.26395409494001043 Classical Simulations 0.45748565466875324 Conformers 0.0 Crystallization 0.009389671361502348 DFTB Plus 0.0 DMol3 0.020865936358894107 DPD 5.216484089723526E-4 Discover 5.216484089723526E-4 Forcite 0.06468440271257173 GULP 0.003129890453834116 LUDI 0.008346374543557642 LibDock 0.10589462702138759 LigandFit 0.005738132498695879 MCSS 0.0010432968179447052 MODELER 0.1554512258737611 Mesocite 0.0 Mesoscale 0.0010432968179447052 Morphology 0.001564945226917058 Polymorph 0.0 QSAR 5.216484089723526E-4 Quantum Mechanics 0.17318727177882107 Reflex 0.006781429316640584 Reflex Plus 0.0 Semi-empirical 0.0 Sorption 0.0036515388628064684 TURBOMOLE 0.0 Visualization 1.0 X-Cell 5.216484089723526E-4 ZDOCK 0.00782472613458529

Year

2021 0.0 2022 0.4653543307086614 2023 0.789763779527559 2024 1.0 2025 0.8661417322834646 2026 0.09448818897637795

Keywords

compound 1.0 target 0.9700419412822049 docking 0.5620131815458358 potential 0.42480527261833434 visualization 0.3499101258238466 analysis 0.24535650089874175 novel 0.24415817855002997 synthesized 0.24236069502696225 synthesis 0.21000599161174355 activity 0.2025164769322948 binding 0.17825044937088078 potent 0.11713600958657878 vitro 0.11593768723786699 promising 0.10275614140203715 inhibition 0.09916117435590174 drug 0.0835829838226483 silico 0.08088675853804674 protein 0.06860395446375075 design 0.02486518873576992 treatment 0.02366686638705812 between 0.015877771120431396 active 0.014979029358897543 development 0.01348112642300779 inhibitor 0.0011983223487118035 interaction 0.0
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