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Application

Discovery Studio 0.967074317968015 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.03832752613240418 Amorphous Cell 0.26480836236933797 CASTEP 0.3507549361207898 CDOCKER 0.18583042973286876 CHARMm 0.3205574912891986 COMPASS 0.33914053426248547 COMPASS III 0.06736353077816493 COSMObase 0.005807200929152149 COSMOconf 0.0023228803716608595 COSMOquick 0.003484320557491289 COSMOtherm 0.07897793263646923 Catalyst 0.21602787456445993 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.09059233449477352 DFTB Plus 0.005807200929152149 DMol3 0.20905923344947736 DPD 0.0023228803716608595 Discover 0.003484320557491289 Forcite 0.4912891986062718 GULP 0.025551684088269456 LUDI 0.018583042973286876 LibDock 0.08013937282229965 LigandFit 0.010452961672473868 MCSS 0.0023228803716608595 MODELER 0.13937282229965156 MesoDyn 0.0 Mesocite 0.004645760743321719 Mesoscale 0.006968641114982578 Morphology 0.025551684088269456 Polymorph 0.0 QMERA 0.0 QSAR 0.005807200929152149 Quantum Mechanics 0.5516840882694541 Reflex 0.06387921022067364 Semi-empirical 0.009291521486643438 Sorption 0.047619047619047616 TURBOMOLE 0.0 VAMP 0.0011614401858304297 Visualization 0.6469221835075494 ZDOCK 0.027874564459930314

Year

2021 0.0 2022 0.25755395683453236 2023 0.3496402877697842 2024 0.8431654676258993 2025 1.0 2026 0.4330935251798561

Keywords

design 1.0 target 0.939117199391172 potential 0.23541349568746828 novel 0.2085235920852359 docking 0.18366311516996447 synthesis 0.1689497716894977 between 0.1339421613394216 analysis 0.1248097412480974 visualization 0.1171993911719939 synthesized 0.10603754439370877 promising 0.0867579908675799 development 0.08016235413495687 energy 0.07407407407407407 performance 0.0730593607305936 activity 0.0700152207001522 cell 0.06189751395230847 designed 0.059868087265347536 compound 0.0563165905631659 binding 0.05428716387620497 stability 0.041603247082699135 effective 0.0410958904109589 potent 0.014713343480466767 strategy 0.008625063419583967 strong 0.0010147133434804667 efficient 0.0
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