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Application

Discovery Studio 0.685077519379845 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06398809523809523 Amorphous Cell 0.27157738095238093 Blends 0.002232142857142857 CASTEP 0.5744047619047619 CDOCKER 0.09970238095238096 CHARMm 0.28794642857142855 COMPASS 0.33407738095238093 COMPASS III 0.09821428571428571 COSMObase 7.44047619047619E-4 COSMOconf 0.003720238095238095 COSMOquick 7.44047619047619E-4 COSMOtherm 0.022321428571428572 Cantera 0.0 Catalyst 0.09821428571428571 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06101190476190476 DFTB Plus 0.003720238095238095 DMol3 0.24925595238095238 DPD 0.001488095238095238 Discover 0.001488095238095238 Forcite 0.5297619047619048 GULP 0.020833333333333332 Kinetix 0.0 LUDI 0.005208333333333333 LibDock 0.03720238095238095 LigandFit 0.001488095238095238 MODELER 0.16741071428571427 MesoDyn 0.0 Mesocite 0.0 Mesoscale 0.002976190476190476 Morphology 0.012648809523809524 ONETEP 0.001488095238095238 Polymorph 0.002232142857142857 QMERA 7.44047619047619E-4 Quantum Mechanics 0.8110119047619048 Reflex 0.04389880952380952 Reflex Plus 0.0 Semi-empirical 0.005952380952380952 Sorption 0.036458333333333336 Synthia 0.002232142857142857 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.6153273809523809 X-Cell 7.44047619047619E-4 ZDOCK 0.012648809523809524

Year

2021 0.04941860465116279 2022 0.10319767441860465 2023 0.279796511627907 2024 0.7078488372093024 2025 1.0 2026 0.45930232558139533 2027 0.0

Keywords

stable 1.0 target 0.9285480170435922 potential 0.3162897410685021 analysis 0.2238610291707637 docking 0.19436250409701736 stability 0.18125204850868568 energy 0.17436905932481153 between 0.15306456899377252 binding 0.1245493280891511 visualization 0.10127826941986234 novel 0.0862012454932809 promising 0.07472959685349066 interaction 0.05703048180924287 performance 0.05014749262536873 cell 0.03638151425762045 protein 0.035070468698787285 formation 0.03179285480170436 complex 0.02097672894133071 strong 0.01671583087512291 experimental 0.015404785316289742 activity 0.00950508030154048 effective 0.006227466404457555 development 0.0058997050147492625 higher 0.005571943625040971 enhanced 0.0
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