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Application

Discovery Studio 0.7947727947727947 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06655199788303784 Amorphous Cell 0.29187615771368086 Blends 0.0025138925641704155 CASTEP 0.3858163535326806 CDOCKER 0.1413072241333686 CHARMm 0.2287642233395078 COMPASS 0.36768986504366236 COMPASS III 0.09698332892299551 COSMObase 0.004366234453559143 COSMOconf 0.005292405398253507 COSMOmic 1.3231013495633765E-4 COSMOperm 0.0013231013495633766 COSMOplex 1.3231013495633765E-4 COSMOquick 0.0014554114845197143 COSMOtherm 0.06655199788303784 Cantera 0.0 Catalyst 0.08137073299814766 Classical Simulations 1.0 Conformers 7.938608097380259E-4 Crystallization 0.07369674517068008 DFTB Plus 0.005292405398253507 DMol3 0.1738555173326277 DPD 0.0023815824292140776 Discover 0.0037046837787774543 Forcite 0.560730351944959 GULP 0.02196348240275205 Kinetix 2.646202699126753E-4 LUDI 0.0027785128340830907 LibDock 0.05940725059539561 LigandFit 0.0037046837787774543 MCSS 3.9693040486901297E-4 MODELER 0.2150039693040487 MesoDyn 7.938608097380259E-4 Mesocite 0.0031754432389521038 Mesoscale 0.005953956073035195 Modules 0.0 Morphology 0.017200317544323895 ONETEP 0.0011907912146070388 Polymorph 0.001984652024345065 QMERA 1.3231013495633765E-4 QSAR 9.261709446943636E-4 Quantum Mechanics 0.5484255093940196 Reflex 0.05345329452236041 Reflex Plus 0.0011907912146070388 Semi-empirical 0.006880127017729558 Sorption 0.05901032019052659 Synthia 0.0013231013495633766 TURBOMOLE 3.9693040486901297E-4 VAMP 0.0011907912146070388 Visualization 0.6565228896533475 X-Cell 0.0015877216194760519 ZDOCK 0.024477374966922465

Year

2023 0.037602595915251 2024 0.43281160526818097 2025 1.0 2026 0.40561175796907806 2027 0.0

Keywords

target 1.0 potential 0.28541454730417093 analysis 0.19811800610376398 docking 0.1834944048830112 between 0.1614318413021363 visualization 0.15214903357070192 energy 0.10230162767039674 novel 0.09460834181078331 promising 0.07566124109867751 cell 0.07133774160732452 binding 0.05658697863682604 performance 0.053344354018311294 stability 0.04361648016276704 activity 0.03833926754832147 experimental 0.031472533062054935 including 0.023016276703967446 synthesized 0.022316887080366225 effective 0.021172431332655138 interaction 0.02066378433367243 mechanism 0.019074262461851475 development 0.017993387589013223 enhanced 0.014114954221770091 design 0.0038148524923702952 strong 0.001525940996948118 synthesis 0.0
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