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Application

Discovery Studio 0.9359246171967021 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06203331418724871 Amorphous Cell 0.28087306145893165 Blends 0.002010338885697875 CASTEP 0.3210798391728891 CDOCKER 0.16255025847214244 CHARMm 0.2584721424468696 COMPASS 0.3429063756461804 COMPASS III 0.10798391728891442 COSMObase 0.005169442848937392 COSMOconf 0.0060310166570936245 COSMOmic 0.0 COSMOperm 5.743825387708214E-4 COSMOplex 2.871912693854107E-4 COSMOquick 8.615738081562321E-4 COSMOtherm 0.06691556576680069 Catalyst 0.07438253877082136 Classical Simulations 1.0 Conformers 5.743825387708214E-4 Crystallization 0.0778288340034463 DFTB Plus 0.002871912693854107 DMol3 0.14847788627225733 DPD 0.0022975301550832855 Discover 0.004595060310166571 Forcite 0.5336013785180931 GULP 0.015508328546812177 Kinetix 2.871912693854107E-4 LUDI 0.00430786904078116 LibDock 0.06605399195864446 LigandFit 0.0031591039632395176 MODELER 0.2478460654796094 Mesocite 0.0031591039632395176 Mesoscale 0.005169442848937392 Morphology 0.018380241240666284 ONETEP 0.0011487650775416428 Polymorph 0.0022975301550832855 QMERA 2.871912693854107E-4 QSAR 2.871912693854107E-4 Quantum Mechanics 0.4623779437105112 Reflex 0.05571510626076967 Reflex Plus 5.743825387708214E-4 Semi-empirical 0.004595060310166571 Sorption 0.05887421022400919 Synthia 5.743825387708214E-4 TURBOMOLE 0.0 VAMP 8.615738081562321E-4 Visualization 0.6568064330844342 X-Cell 0.0017231476163124641 ZDOCK 0.026708788052843192

Year

2024 0.1722941720629047 2025 1.0 2026 0.8896854764107308 2027 0.0

Keywords

target 1.0 potential 0.30933017891468284 analysis 0.22460446547390212 docking 0.2149933461481591 visualization 0.1530385923406772 between 0.1385479816649416 promising 0.09389324264379713 novel 0.08590862043471832 energy 0.07792399822563952 binding 0.0720094632559515 cell 0.06372911429838829 performance 0.04554191926659766 stability 0.045246192518113265 activity 0.04258465178175366 including 0.024101730001478635 strong 0.023953866627236434 enhanced 0.018039331657548424 effective 0.015969244418157624 experimental 0.012568386810587017 development 0.011089753068165016 mechanism 0.009906846074227415 synthesized 0.009315392577258613 strategy 0.006210261718172409 design 0.001330770368179802 interaction 0.0
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