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Application

Discovery Studio 1.0 Materials Studio 0.9333230911046244 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05815831987075929 Amorphous Cell 0.27463651050080773 Blends 0.0022213247172859453 CASTEP 0.3331987075928918 CDOCKER 0.17467689822294022 CHARMm 0.27120355411954766 COMPASS 0.34592084006462037 COMPASS III 0.10197899838449112 COSMObase 0.003836833602584814 COSMOconf 0.005048465266558966 COSMOmic 2.0193861066235866E-4 COSMOperm 0.0012116316639741518 COSMOplex 2.0193861066235866E-4 COSMOquick 8.077544426494346E-4 COSMOtherm 0.06320678513731826 Catalyst 0.10197899838449112 Classical Simulations 1.0 Conformers 4.038772213247173E-4 Crystallization 0.07189014539579967 DFTB Plus 0.005250403877221325 DMol3 0.15508885298869143 DPD 0.0026252019386106625 Discover 0.0032310177705977385 Forcite 0.5278675282714055 GULP 0.018982229402261713 Kinetix 2.0193861066235866E-4 LUDI 0.002827140549273021 LibDock 0.07249596122778676 LigandFit 0.004240710823909532 MODELER 0.23929725363489499 MesoDyn 2.0193861066235866E-4 Mesocite 0.002827140549273021 Mesoscale 0.005452342487883684 Modules 0.0 Morphology 0.017164781906300483 ONETEP 0.0012116316639741518 Polymorph 0.0022213247172859453 QMERA 2.0193861066235866E-4 QSAR 4.038772213247173E-4 Quantum Mechanics 0.47940226171243944 Reflex 0.051494345718901456 Reflex Plus 0.0014135702746365104 Semi-empirical 0.006663974151857835 Sorption 0.060379644588045234 Synthia 0.0018174474959612278 TURBOMOLE 2.0193861066235866E-4 VAMP 8.077544426494346E-4 Visualization 0.7932148626817448 X-Cell 0.0012116316639741518 ZDOCK 0.028675282714054926

Year

2023 0.13889312395182193 2024 0.379631041317274 2025 1.0 2026 0.5416984296386644 2027 0.0

Keywords

target 1.0 potential 0.303536619326093 docking 0.23196881091617932 analysis 0.21108326371484265 visualization 0.193632228719948 between 0.14517775921284692 novel 0.09793001021071196 promising 0.07732293697205977 binding 0.07630186577554998 energy 0.0742597233825304 cell 0.0607073238652186 activity 0.05792258423837371 stability 0.03601596584052724 performance 0.028682818156502365 synthesized 0.025248305950060335 interaction 0.022834864940128097 including 0.021442495126705652 development 0.019121878771001577 mechanism 0.01670843776106934 effective 0.016337139144156687 experimental 0.01550171725610322 protein 0.009468114731272625 enhanced 0.001670843776106934 synthesis 0.001578019121878771 strong 0.0
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