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Application

Discovery Studio 0.9740316901408451 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0628519527702089 Amorphous Cell 0.2795640326975477 Blends 0.0018165304268846503 CASTEP 0.33969118982742963 CDOCKER 0.16348773841961853 CHARMm 0.2657584014532243 COMPASS 0.34332425068119893 COMPASS III 0.10136239782016349 COSMObase 0.004541326067211626 COSMOconf 0.005812897366030881 COSMOmic 0.0 COSMOperm 5.449591280653951E-4 COSMOplex 1.8165304268846503E-4 COSMOquick 0.0014532243415077202 COSMOtherm 0.06485013623978202 Catalyst 0.08592188919164397 Classical Simulations 1.0 Conformers 3.6330608537693006E-4 Crystallization 0.07175295186194369 DFTB Plus 0.0038147138964577656 DMol3 0.15331516802906447 DPD 0.0023614895549500456 Discover 0.0038147138964577656 Forcite 0.5284287011807448 GULP 0.019436875567665757 Kinetix 1.8165304268846503E-4 LUDI 0.0036330608537693005 LibDock 0.06902815622161672 LigandFit 0.004178019981834696 MCSS 5.449591280653951E-4 MODELER 0.24795640326975477 MesoDyn 7.266121707538601E-4 Mesocite 0.0032697547683923707 Mesoscale 0.005994550408719346 Modules 0.0 Morphology 0.01634877384196185 ONETEP 7.266121707538601E-4 Polymorph 0.0016348773841961854 QMERA 1.8165304268846503E-4 QSAR 5.449591280653951E-4 Quantum Mechanics 0.4833787465940054 Reflex 0.05249772933696639 Reflex Plus 9.082652134423251E-4 Semi-empirical 0.005267938237965486 Sorption 0.05449591280653951 Synthia 0.0010899182561307902 TURBOMOLE 1.8165304268846503E-4 VAMP 9.082652134423251E-4 Visualization 0.7082652134423252 X-Cell 0.0016348773841961854 ZDOCK 0.028337874659400544

Year

2023 0.021808203350664357 2024 0.4662045060658579 2025 1.0 2026 0.6114962449451185 2027 0.0

Keywords

target 1.0 potential 0.2997393570807993 docking 0.2150304083405734 analysis 0.21025195482189402 visualization 0.16576889661164204 between 0.14934839270199826 novel 0.09270199826238054 promising 0.0787141615986099 energy 0.07827975673327542 binding 0.07054735013032146 cell 0.06012163336229366 activity 0.04465682015638575 stability 0.04083405734144222 performance 0.03770634231103388 including 0.02050390964378801 effective 0.01685490877497828 synthesized 0.015638575152041704 experimental 0.014422241529105127 interaction 0.013466550825369244 development 0.01311902693310165 mechanism 0.011902693310165073 enhanced 0.008166811468288444 strong 0.004430929626411816 protein 0.003562119895742832 design 0.0
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