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Application

Discovery Studio 1.0 Materials Studio 0.8496605237633366 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.09502923976608187 Amorphous Cell 0.23976608187134502 Blends 0.0 CASTEP 0.43567251461988304 CDOCKER 0.15789473684210525 CHARMm 0.30994152046783624 COMPASS 0.2982456140350877 COMPASS III 0.1067251461988304 COSMObase 0.0014619883040935672 COSMOconf 0.005847953216374269 COSMOperm 0.0 COSMOtherm 0.06286549707602339 Catalyst 0.10087719298245613 Classical Simulations 1.0 Crystallization 0.059941520467836254 DFTB Plus 0.0029239766081871343 DMol3 0.17543859649122806 Discover 0.0029239766081871343 Forcite 0.4824561403508772 GULP 0.01608187134502924 LUDI 0.005847953216374269 LibDock 0.054093567251461985 LigandFit 0.0 MODELER 0.2807017543859649 Mesocite 0.0 Mesoscale 0.0 Morphology 0.011695906432748537 ONETEP 0.0 Polymorph 0.0 QSAR 0.0014619883040935672 Quantum Mechanics 0.6008771929824561 Reflex 0.04678362573099415 Reflex Plus 0.0 Semi-empirical 0.0043859649122807015 Sorption 0.05847953216374269 VAMP 0.0 Visualization 0.8728070175438597 X-Cell 0.0 ZDOCK 0.01608187134502924

Year

2023 0.0 2024 0.3527751646284102 2025 1.0 2026 0.5644402634054563 2027 0.0

Keywords

strong 1.0 target 0.9131964809384164 potential 0.4351906158357771 docking 0.30674486803519063 analysis 0.2932551319648094 binding 0.19824046920821115 between 0.18944281524926687 visualization 0.15425219941348975 promising 0.1530791788856305 novel 0.09442815249266862 stability 0.08387096774193549 energy 0.06041055718475073 activity 0.05923753665689149 including 0.0563049853372434 interaction 0.04164222873900293 effective 0.03812316715542522 therapeutic 0.031085043988269796 synthesized 0.01466275659824047 development 0.01407624633431085 inhibition 0.01407624633431085 performance 0.011730205278592375 silico 0.007624633431085044 cell 0.0064516129032258064 stable 0.005278592375366569 compound 0.0
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