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Application

Discovery Studio 0.9307411323656638 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07000727176571693 Amorphous Cell 0.2810206914788127 Blends 0.003173134131023997 CASTEP 0.42943081906524755 CDOCKER 0.16824221590533484 CHARMm 0.24267865406227276 COMPASS 0.3868579361406756 COMPASS III 0.06875123950551994 COSMObase 0.0026442784425199975 COSMOconf 0.003040920208897997 COSMOmic 2.644278442519997E-4 COSMOperm 0.0013221392212599988 COSMOplex 4.6274872744099955E-4 COSMOquick 0.0016526740265749983 COSMOtherm 0.06623917498512594 Cantera 6.610696106299993E-5 Catalyst 0.1111258015469029 Classical Simulations 1.0 Conformers 0.0016526740265749983 Crystallization 0.07866728366496992 DFTB Plus 0.006081840417795994 DMol3 0.2011634825147088 DPD 0.0034375619752759967 Discover 0.006015733456732994 Forcite 0.5417465459112845 GULP 0.02888874198453097 Kinetix 1.983208831889998E-4 LUDI 0.005751305612480994 LibDock 0.06690024459575593 LigandFit 0.007998942288622992 MCSS 0.0014543531433859986 MODELER 0.18238910557281682 MesoDyn 0.001917101870826998 Mesocite 0.0048258081575989955 Mesoscale 0.008792225821378992 Modules 0.0 Morphology 0.01877437694189198 ONETEP 0.0013221392212599988 Polymorph 0.002049315792952998 QMERA 3.966417663779996E-4 QSAR 0.0017187809876379983 Quantum Mechanics 0.6171084815231044 Reflex 0.05771137700799894 Reflex Plus 8.593904938189992E-4 Semi-empirical 0.008527797977126992 Sorption 0.05486877768228995 Synthia 0.0013882461823229986 TURBOMOLE 6.610696106299994E-4 VAMP 0.001917101870826998 Visualization 0.8410788656045481 X-Cell 0.0011238183380709989 ZDOCK 0.029219276789845972

Year

2020 0.07801538331501987 2021 0.2552616008790466 2022 0.29549488631561155 2023 0.694615839743048 2024 1.0 2025 0.9666976586932634 2026 0.35931028653537317 2027 0.0

Keywords

target 1.0 potential 0.2431752069814276 visualization 0.19847840680241666 docking 0.19526180353546654 analysis 0.16608861042738868 between 0.15339002013873348 novel 0.0926381740881629 energy 0.08570149921682703 binding 0.05982882076527187 cell 0.058514208995300965 activity 0.044864622958156186 interaction 0.03773215484448422 promising 0.03736853882300291 experimental 0.03157865294249273 synthesized 0.025145446408592526 stability 0.021341463414634148 mechanism 0.017957037368538823 performance 0.01392929066905348 effective 0.01328597001566346 protein 0.01261467889908257 development 0.011719624076974714 synthesis 0.00825128664130678 chemical 0.003859923920340121 including 0.0028250167822779144 design 0.0
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