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Application

Discovery Studio 0.7966081733600283 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06757604264659768 Amorphous Cell 0.2944496707431797 Blends 0.002508623392913139 CASTEP 0.3797428661022264 CDOCKER 0.1407964879272499 CHARMm 0.2273439949827532 COMPASS 0.3651614926309188 COMPASS III 0.09909062402006899 COSMObase 0.004390090937597993 COSMOconf 0.0061147695202257765 COSMOmic 0.0 COSMOperm 9.407337723424271E-4 COSMOplex 3.1357792411414236E-4 COSMOquick 0.0014111006585136407 COSMOtherm 0.06898714330511133 Cantera 0.0 Catalyst 0.08137347130761995 Classical Simulations 1.0 Conformers 4.7036688617121356E-4 Crystallization 0.07447475697710881 DFTB Plus 0.005801191596111634 DMol3 0.17058639071809345 DPD 0.002508623392913139 Discover 0.004076513013483851 Forcite 0.5583254938852305 GULP 0.020696142991533398 Kinetix 3.1357792411414236E-4 LUDI 0.003606146127312637 LibDock 0.05832549388523048 LigandFit 0.003292568203198495 MCSS 3.1357792411414236E-4 MODELER 0.20633427406710567 MesoDyn 7.839448102853559E-4 Mesocite 0.0029789902790843524 Mesoscale 0.005801191596111634 Modules 0.0 Morphology 0.017403574788334902 ONETEP 0.0012543116964565694 Polymorph 0.0021950454687989967 QMERA 1.5678896205707118E-4 QSAR 9.407337723424271E-4 Quantum Mechanics 0.5399811853245532 Reflex 0.053621825023518345 Reflex Plus 7.839448102853559E-4 Semi-empirical 0.007369081216682345 Sorption 0.060206961429915336 Synthia 0.0014111006585136407 TURBOMOLE 6.271558482282847E-4 VAMP 0.0010975227343994983 Visualization 0.662903731577297 X-Cell 0.0015678896205707118 ZDOCK 0.024459078080903106

Year

2023 0.08312698974177574 2024 0.373305034783634 2025 1.0 2026 0.499115670321896 2027 0.0

Keywords

target 1.0 potential 0.28555253623188404 analysis 0.19897342995169082 docking 0.18636775362318841 between 0.1621376811594203 visualization 0.15496678743961353 energy 0.10137379227053141 novel 0.09269323671497584 promising 0.0745018115942029 cell 0.07238828502415459 binding 0.057065217391304345 performance 0.05306461352657005 stability 0.044308574879227056 activity 0.04045893719806763 experimental 0.03147644927536232 synthesized 0.02347524154589372 including 0.02339975845410628 effective 0.020757850241545892 enhanced 0.018191425120772948 interaction 0.017814009661835748 development 0.016983695652173912 mechanism 0.016757246376811596 strong 0.00777475845410628 design 0.00581219806763285 synthesis 0.0
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