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Application

Discovery Studio 1.0 Materials Studio 0.9819604086845466 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06870548806032677 Amorphous Cell 0.28005865102639294 Blends 0.002304147465437788 CASTEP 0.3814411395056556 CDOCKER 0.16547968160871387 CHARMm 0.27063259321323835 COMPASS 0.3521156263091747 COMPASS III 0.07875994972769167 COSMObase 0.003142019271051529 COSMOconf 0.003770423125261835 COSMOperm 0.0010473397570171764 COSMOquick 0.001466275659824047 COSMOtherm 0.05927943024717218 Cantera 0.0 Catalyst 0.12484289903644742 Classical Simulations 1.0 Conformers 6.284038542103058E-4 Crystallization 0.07121910347716799 DFTB Plus 0.0035609551738583997 DMol3 0.1656891495601173 DPD 0.0025136154168412233 Discover 0.004398826979472141 Forcite 0.5278592375366569 GULP 0.0213657310431504 LUDI 0.005655634687892753 LibDock 0.06933389191453708 LigandFit 0.005446166736489317 MCSS 0.0010473397570171764 MODELER 0.19438625890238795 MesoDyn 0.0010473397570171764 Mesocite 0.003770423125261835 Mesoscale 0.006702974444909929 Morphology 0.01717637201508169 ONETEP 8.378718056137411E-4 Polymorph 0.0012568077084206116 QMERA 0.0 QSAR 0.0010473397570171764 Quantum Mechanics 0.5368663594470046 Reflex 0.052157519899455385 Reflex Plus 4.1893590280687055E-4 Semi-empirical 0.005655634687892753 Sorption 0.05090071219103477 Synthia 2.0946795140343527E-4 TURBOMOLE 6.284038542103058E-4 VAMP 0.0016757436112274822 Visualization 0.8242563887725178 X-Cell 0.0016757436112274822 ZDOCK 0.028906577293674067

Year

2022 0.042647319058573704 2023 0.35975933463103876 2024 0.5756503273756857 2025 1.0 2026 0.3744470005308795 2027 0.0

Keywords

target 1.0 potential 0.2856479331165815 docking 0.2272178355782629 visualization 0.20232234091964701 analysis 0.1934974454249884 between 0.14862981885740828 novel 0.09986065954482118 energy 0.07942405945192754 binding 0.0763585694379935 cell 0.058522991175104504 promising 0.056572224802601025 activity 0.05127728750580585 stability 0.035392475615420346 interaction 0.03214119832791454 performance 0.024616813748258245 experimental 0.023873664653971203 synthesized 0.023502090106827682 protein 0.02090106827682304 effective 0.01764979098931723 mechanism 0.01709242916860195 including 0.01607059916395727 development 0.015977705527171388 synthesis 0.008174640037157455 design 0.0018578727357176034 chemical 0.0
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