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Application

Discovery Studio 1.0 Materials Studio 0.8139890042761149 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057380457380457384 Amorphous Cell 0.2602910602910603 Blends 0.002494802494802495 CASTEP 0.28024948024948027 CDOCKER 0.19002079002079003 CHARMm 0.3106029106029106 COMPASS 0.3176715176715177 COMPASS III 0.09896049896049897 COSMObase 0.0037422037422037424 COSMOconf 0.0058212058212058215 COSMOmic 0.0 COSMOperm 8.316008316008316E-4 COSMOquick 0.0 COSMOtherm 0.05945945945945946 Catalyst 0.08814968814968815 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06860706860706861 DFTB Plus 0.0012474012474012475 DMol3 0.13056133056133057 DPD 0.0016632016632016633 Discover 0.006237006237006237 Forcite 0.49771309771309774 GULP 0.013305613305613306 Kinetix 0.0 LUDI 0.004573804573804574 LibDock 0.07983367983367984 LigandFit 0.004573804573804574 MCSS 0.0 MODELER 0.28274428274428276 MesoDyn 8.316008316008316E-4 Mesocite 0.002494802494802495 Mesoscale 0.00498960498960499 Morphology 0.01496881496881497 ONETEP 8.316008316008316E-4 Polymorph 0.0016632016632016633 QMERA 0.0 QSAR 4.158004158004158E-4 Quantum Mechanics 0.40374220374220376 Reflex 0.05072765072765073 Reflex Plus 0.0 Semi-empirical 0.002494802494802495 Sorption 0.050311850311850315 Synthia 0.0 TURBOMOLE 0.0 VAMP 4.158004158004158E-4 Visualization 0.7496881496881497 X-Cell 0.0012474012474012475 ZDOCK 0.03367983367983368

Year

2024 0.2242210086733055 2025 1.0 2026 0.8175393511082557 2027 0.0

Keywords

target 1.0 potential 0.32975491188981165 docking 0.2621024913915333 analysis 0.23313753291472555 visualization 0.18087907636216324 between 0.13652015393963945 novel 0.10249139153331983 binding 0.09864290054689083 promising 0.09540206603200324 activity 0.06015799068260077 cell 0.05468908243872797 energy 0.04678954830868949 stability 0.03686449260684626 strong 0.02916751063398825 including 0.025724123961920194 therapeutic 0.02147052866113024 development 0.01985011140368645 performance 0.017014381203159814 synthesized 0.013165890216730808 effective 0.012963338059550335 mechanism 0.011545472959287017 protein 0.009317399230301802 enhanced 0.006886773344136115 interaction 0.0034433866720680576 synthesis 0.0
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