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Application

Discovery Studio 1.0 Materials Studio 0.9387605963168664 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05776930409914204 Amorphous Cell 0.27721639656816016 Blends 0.0020972354623450904 CASTEP 0.3374642516682555 CDOCKER 0.17616777883698762 CHARMm 0.2755004766444233 COMPASS 0.34318398474737843 COMPASS III 0.10028598665395615 COSMObase 0.00438512869399428 COSMOconf 0.005147759771210677 COSMOmic 1.9065776930409913E-4 COSMOperm 5.719733079122975E-4 COSMOplex 1.9065776930409913E-4 COSMOquick 9.532888465204957E-4 COSMOtherm 0.0646329837940896 Catalyst 0.09571020019065776 Classical Simulations 1.0 Conformers 3.8131553860819826E-4 Crystallization 0.07225929456625357 DFTB Plus 0.004194470924690181 DMol3 0.15519542421353671 DPD 0.0020972354623450904 Discover 0.004194470924690181 Forcite 0.5224022878932316 GULP 0.01830314585319352 Kinetix 1.9065776930409913E-4 LUDI 0.0036224976167778837 LibDock 0.07321258341277408 LigandFit 0.00438512869399428 MCSS 0.0 MODELER 0.25490943755958057 MesoDyn 5.719733079122975E-4 Mesocite 0.002669208770257388 Mesoscale 0.005147759771210677 Modules 0.0 Morphology 0.017349857006673023 ONETEP 9.532888465204957E-4 Polymorph 0.00228789323164919 QMERA 1.9065776930409913E-4 QSAR 5.719733079122975E-4 Quantum Mechanics 0.4833174451858913 Reflex 0.05185891325071497 Reflex Plus 0.001143946615824595 Semi-empirical 0.005719733079122974 Sorption 0.056816015252621546 Synthia 9.532888465204957E-4 TURBOMOLE 1.9065776930409913E-4 VAMP 9.532888465204957E-4 Visualization 0.7706387035271687 X-Cell 0.001334604385128694 ZDOCK 0.02897998093422307

Year

2023 0.07852927825692238 2024 0.46209714026327736 2025 1.0 2026 0.6202148585262521 2027 0.0

Keywords

target 1.0 potential 0.3030867482703566 docking 0.2307965229732127 analysis 0.2141209863402519 visualization 0.18210040801844954 between 0.1447578499201703 novel 0.09721483058364379 promising 0.07974099698421146 binding 0.07637040979244279 energy 0.07193542664537875 cell 0.05818697888948022 activity 0.054106794394181305 stability 0.03751995742416179 performance 0.029536987759446513 synthesized 0.020046123824729464 including 0.017739932588256166 development 0.015522441014724143 effective 0.013038850452368281 interaction 0.012063154160014192 mechanism 0.01188575483413163 experimental 0.010910058541777541 protein 0.005676778428241973 enhanced 0.0033705871917686712 strong 6.208976405889658E-4 synthesis 0.0
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