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Application

Discovery Studio 1.0 Materials Studio 0.9960264900662251 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0631214221150949 Amorphous Cell 0.2791503464899066 Blends 0.002259716782163302 CASTEP 0.3499548056643567 CDOCKER 0.16736968966556193 CHARMm 0.26950888821934316 COMPASS 0.3439288942452546 COMPASS III 0.0949081048508587 COSMObase 0.004368785778849051 COSMOconf 0.005272672491714371 COSMOmic 0.0 COSMOperm 6.025911419102139E-4 COSMOplex 1.5064778547755348E-4 COSMOquick 0.0013558300692979813 COSMOtherm 0.06387466104248267 Cantera 0.0 Catalyst 0.09792106056040976 Classical Simulations 1.0 Conformers 6.025911419102139E-4 Crystallization 0.06944862910515215 DFTB Plus 0.004670081349804158 DMol3 0.1560711057547454 DPD 0.0021090689966857487 Discover 0.00346489906598373 Forcite 0.5281711358843025 GULP 0.01913226875564929 Kinetix 1.5064778547755348E-4 LUDI 0.0036155468514612837 LibDock 0.07005122024706237 LigandFit 0.004067490207893944 MCSS 6.025911419102139E-4 MODELER 0.2341066586321181 MesoDyn 6.025911419102139E-4 Mesocite 0.0033142512805061767 Mesoscale 0.005724615848147032 Modules 0.0 Morphology 0.015516721904188008 ONETEP 7.532389273877674E-4 Polymorph 0.001958421211208195 QMERA 1.5064778547755348E-4 QSAR 6.025911419102139E-4 Quantum Mechanics 0.49638445314853874 Reflex 0.05061765592045797 Reflex Plus 9.038867128653209E-4 Semi-empirical 0.0061765592045796925 Sorption 0.05543838505573968 Synthia 9.038867128653209E-4 TURBOMOLE 4.5194335643266047E-4 VAMP 0.0010545344983428743 Visualization 0.7511298583910817 X-Cell 0.0016571256402530884 ZDOCK 0.027568544742392287

Year

2023 0.10835876966424043 2024 0.4904907255224231 2025 1.0 2026 0.49847382014557406 2027 0.0

Keywords

target 1.0 potential 0.2959910602039391 docking 0.22293616426875262 analysis 0.20805978488615728 visualization 0.180611817292918 between 0.14974158402011453 novel 0.09875680961028077 energy 0.07871211062997625 promising 0.07361363318899287 binding 0.07193742142757369 cell 0.06104204497834893 activity 0.05035619499930158 stability 0.04015924011733482 performance 0.03352423522838385 including 0.021511384271546304 synthesized 0.021022489174465708 experimental 0.02032406760720771 interaction 0.01997485682357871 effective 0.017390697024724122 mechanism 0.015365274479675933 development 0.015085905852772733 protein 0.011174745076127951 enhanced 0.005238161754434977 synthesis 0.0032127392093867857 design 0.0
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