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Application

Discovery Studio 1.0 Materials Studio 0.9253231211105792 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05729794933655006 Amorphous Cell 0.27261761158021713 Blends 0.0018094089264173703 CASTEP 0.30367913148371534 CDOCKER 0.1764173703256936 CHARMm 0.2861881785283474 COMPASS 0.3338359469240048 COMPASS III 0.10283474065138722 COSMObase 0.0048250904704463205 COSMOconf 0.006332931242460796 COSMOmic 0.0 COSMOperm 6.031363088057901E-4 COSMOplex 3.0156815440289503E-4 COSMOquick 6.031363088057901E-4 COSMOtherm 0.06182147165259349 Catalyst 0.07689987937273823 Classical Simulations 1.0 Conformers 3.0156815440289503E-4 Crystallization 0.0735826296743064 DFTB Plus 0.0030156815440289505 DMol3 0.14294330518697226 DPD 0.0018094089264173703 Discover 0.005428226779252111 Forcite 0.5129674306393245 GULP 0.015379975874547648 Kinetix 0.0 LUDI 0.0048250904704463205 LibDock 0.07237635705669482 LigandFit 0.0039203860072376355 MCSS 0.0 MODELER 0.2693003618817853 MesoDyn 6.031363088057901E-4 Mesocite 0.0030156815440289505 Mesoscale 0.005428226779252111 Morphology 0.016887816646562123 ONETEP 6.031363088057901E-4 Polymorph 0.0024125452352231603 QMERA 3.0156815440289503E-4 QSAR 3.0156815440289503E-4 Quantum Mechanics 0.4384800965018094 Reflex 0.05307599517490953 Reflex Plus 6.031363088057901E-4 Semi-empirical 0.004523522316043426 Sorption 0.05609167671893848 Synthia 6.031363088057901E-4 TURBOMOLE 0.0 VAMP 6.031363088057901E-4 Visualization 0.7095898673100121 X-Cell 0.0015078407720144752 ZDOCK 0.02985524728588661

Year

2024 0.22590286425902864 2025 1.0 2026 0.9310087173100872 2027 0.0

Keywords

target 1.0 potential 0.32429949471750114 docking 0.2429949471750115 analysis 0.23181748583677844 visualization 0.17133670188332567 between 0.13872301332108405 promising 0.09508497932935232 novel 0.09416628387689481 binding 0.08880722707089267 energy 0.06476802939825448 cell 0.058643393048537745 activity 0.051140713520134745 stability 0.043025570356760065 performance 0.029704486296126167 including 0.025111009033838616 strong 0.02388608176389527 effective 0.015464706783034757 development 0.01423977951309141 mechanism 0.00964630225080386 enhanced 0.00949318634206094 synthesized 0.00949318634206094 therapeutic 0.001990506813657939 interaction 0.001531159087429184 experimental 4.5934772622875517E-4 protein 0.0
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