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Application

Discovery Studio 1.0 Materials Studio 0.984100599841006 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06653771760154739 Amorphous Cell 0.2748549323017408 Blends 0.0027079303675048355 CASTEP 0.3973887814313346 CDOCKER 0.17456479690522245 CHARMm 0.2637330754352031 COMPASS 0.36121856866537716 COMPASS III 0.08104448742746614 COSMObase 0.0032882011605415862 COSMOconf 0.003965183752417795 COSMOmic 2.901353965183752E-4 COSMOperm 0.0013539651837524177 COSMOplex 1.9342359767891682E-4 COSMOquick 0.0014506769825918763 COSMOtherm 0.06160541586073501 Cantera 0.0 Catalyst 0.12040618955512572 Classical Simulations 1.0 Conformers 0.0010638297872340426 Crystallization 0.07485493230174081 DFTB Plus 0.005029013539651838 DMol3 0.179110251450677 DPD 0.0027079303675048355 Discover 0.004061895551257254 Forcite 0.5331721470019343 GULP 0.023984526112185687 Kinetix 2.901353965183752E-4 LUDI 0.005125725338491296 LibDock 0.07098646034816247 LigandFit 0.006382978723404255 MCSS 8.704061895551257E-4 MODELER 0.19864603481624757 MesoDyn 0.0011605415860735009 Mesocite 0.003578336557059961 Mesoscale 0.006769825918762089 Modules 0.0 Morphology 0.01711798839458414 ONETEP 0.0013539651837524177 Polymorph 0.0019342359767891683 QMERA 1.9342359767891682E-4 QSAR 9.671179883945841E-4 Quantum Mechanics 0.5650870406189555 Reflex 0.05522243713733076 Reflex Plus 8.704061895551257E-4 Semi-empirical 0.006769825918762089 Sorption 0.055802707930367505 Synthia 0.0011605415860735009 TURBOMOLE 4.8355899419729207E-4 VAMP 0.0013539651837524177 Visualization 0.8491295938104448 X-Cell 0.0012572533849129594 ZDOCK 0.02920696324951644

Year

2021 0.07036768701322224 2022 0.1543198695888426 2023 0.30691903640644813 2024 0.7426190907444303 2025 1.0 2026 0.3849846042383626 2027 0.0

Keywords

target 1.0 potential 0.2779422187017968 docking 0.22128653020386044 visualization 0.2068620502772335 analysis 0.19172885312877808 between 0.1525826489348397 novel 0.10230541543335973 energy 0.08471255263267603 binding 0.07383165881519156 cell 0.059824071371993165 promising 0.05536332179930796 activity 0.05477967232250802 interaction 0.03835410847542419 stability 0.033393087922624756 synthesized 0.028974027598282402 experimental 0.02613915871096844 performance 0.024304831783882937 effective 0.020094217701254847 mechanism 0.020094217701254847 protein 0.01800975528411223 development 0.01755117355234085 including 0.014341101429941218 synthesis 0.013382248718055613 design 0.001542502188685538 chemical 0.0
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