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Application

Discovery Studio 0.8823041856610029 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06415425065731814 Amorphous Cell 0.2885188431200701 Blends 0.0021034180543382996 CASTEP 0.35267309377738826 CDOCKER 0.1556529360210342 CHARMm 0.24715162138475022 COMPASS 0.35179666958808065 COMPASS III 0.10376862401402279 COSMObase 0.004557405784399649 COSMOconf 0.005959684487291849 COSMOmic 0.0 COSMOperm 3.5056967572304995E-4 COSMOplex 1.7528483786152498E-4 COSMOquick 0.0014022787028921998 COSMOtherm 0.06765994741454864 Catalyst 0.07659947414548642 Classical Simulations 1.0 Conformers 3.5056967572304995E-4 Crystallization 0.07204206836108677 DFTB Plus 0.004206836108676599 DMol3 0.15687992988606486 DPD 0.0019281332164767747 Discover 0.0036809815950920245 Forcite 0.5428571428571428 GULP 0.020157756354075372 Kinetix 1.7528483786152498E-4 LUDI 0.0036809815950920245 LibDock 0.06538124452234882 LigandFit 0.0036809815950920245 MCSS 5.258545135845749E-4 MODELER 0.23137598597721298 MesoDyn 7.011393514460999E-4 Mesocite 0.0029798422436459245 Mesoscale 0.005433829973707274 Modules 0.0 Morphology 0.016301489921121824 ONETEP 8.764241893076249E-4 Polymorph 0.0021034180543382996 QMERA 1.7528483786152498E-4 QSAR 5.258545135845749E-4 Quantum Mechanics 0.5000876424189308 Reflex 0.05241016652059597 Reflex Plus 7.011393514460999E-4 Semi-empirical 0.005784399649430325 Sorption 0.05679228746713409 Synthia 0.0010517090271691498 TURBOMOLE 3.5056967572304995E-4 VAMP 0.0010517090271691498 Visualization 0.6655565293602104 X-Cell 0.0015775635407537247 ZDOCK 0.02751971954425942

Year

2023 5.410523468145543E-4 2024 0.42594346002975786 2025 1.0 2026 0.574462329230353 2027 0.0

Keywords

target 1.0 potential 0.2968063534978033 analysis 0.20817843866171004 docking 0.20091247042919905 between 0.1550354849611355 visualization 0.15452855694491383 novel 0.09513349104427171 energy 0.09116255491720175 promising 0.0819533626225076 cell 0.06919567421426158 binding 0.06497127407908077 performance 0.050439337614058805 activity 0.04537005745184184 stability 0.04275092936802974 including 0.024501520784048665 experimental 0.024163568773234202 effective 0.021459952686718485 synthesized 0.01985468063534978 development 0.017826968570462995 enhanced 0.016982088543426834 mechanism 0.016728624535315983 interaction 0.014616424467725583 strong 0.009885096316323082 design 0.005238256167624198 strategy 0.0
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