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Application

Discovery Studio 0.7940874914559125 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06784199955367105 Amorphous Cell 0.2968087480473109 Blends 0.0017853157777281857 CASTEP 0.35840214237893325 CDOCKER 0.14014728855166259 CHARMm 0.22249497879937513 COMPASS 0.36598973443427807 COMPASS III 0.10354831510823477 COSMObase 0.004240124972104441 COSMOconf 0.006471769694264673 COSMOmic 0.0 COSMOperm 0.0011158223610801161 COSMOplex 2.231644722160232E-4 COSMOquick 6.694934166480696E-4 COSMOtherm 0.07230528899799152 Catalyst 0.07833072974782415 Classical Simulations 1.0 Conformers 4.463289444320464E-4 Crystallization 0.07654541397009595 DFTB Plus 0.005802276277616604 DMol3 0.16224057130104888 DPD 0.002454809194376255 Discover 0.004016960499888418 Forcite 0.5659451015398349 GULP 0.017183664360633788 Kinetix 2.231644722160232E-4 LUDI 0.003347467083240348 LibDock 0.0557911180540058 LigandFit 0.003347467083240348 MCSS 4.463289444320464E-4 MODELER 0.21200624860522205 MesoDyn 2.231644722160232E-4 Mesocite 0.003124302611024325 Mesoscale 0.00557911180540058 Morphology 0.01896898013836197 ONETEP 0.0011158223610801161 Polymorph 0.0015621513055121626 QMERA 2.231644722160232E-4 QSAR 6.694934166480696E-4 Quantum Mechanics 0.5123856282079893 Reflex 0.05445213122070966 Reflex Plus 6.694934166480696E-4 Semi-empirical 0.007810756527560812 Sorption 0.060254407498326265 Synthia 0.0013389868332961392 TURBOMOLE 4.463289444320464E-4 VAMP 0.0013389868332961392 Visualization 0.6449453247043071 X-Cell 0.0017853157777281857 ZDOCK 0.024101762999330506

Year

2023 0.012656033287101248 2024 0.37430651872399445 2025 1.0 2026 0.6007281553398058 2027 0.0

Keywords

target 1.0 potential 0.28008321471586556 analysis 0.19872988065257857 docking 0.180335048724406 between 0.15307127997372166 visualization 0.14715865542538048 energy 0.09252162487682032 novel 0.08387167414869155 promising 0.07237490419358371 cell 0.06832366144749809 performance 0.05452753750136866 binding 0.052994634840687616 stability 0.03876053870579218 activity 0.0361327055731961 experimental 0.027373261797875834 including 0.01905179021132158 synthesized 0.01905179021132158 enhanced 0.01675243622030001 mechanism 0.016533450125917004 effective 0.015329026606810467 development 0.011387276907916348 interaction 0.007992992444979743 strong 0.005365159312383664 design 8.759443775320267E-4 strategy 0.0
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