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Application

Discovery Studio 0.9824357333953705 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06341032808592026 Amorphous Cell 0.2820361924378402 Blends 0.001912608503751655 CASTEP 0.3545681918493453 CDOCKER 0.16242459908783285 CHARMm 0.2571722818890687 COMPASS 0.353979696925114 COMPASS III 0.09724878622921877 COSMObase 0.004119464469618949 COSMOconf 0.005443578049139326 COSMOmic 1.4712373105781962E-4 COSMOperm 0.001176989848462557 COSMOplex 1.4712373105781962E-4 COSMOquick 0.0014712373105781962 COSMOtherm 0.06488156539649846 Catalyst 0.09621892011181403 Classical Simulations 1.0 Conformers 2.9424746211563924E-4 Crystallization 0.07150213329410034 DFTB Plus 0.004855083124908048 DMol3 0.1603648668530234 DPD 0.002353979696925114 Discover 0.0036780932764454905 Forcite 0.5387671031337354 GULP 0.020450198617036928 Kinetix 1.4712373105781962E-4 LUDI 0.0033838458143298513 LibDock 0.06988377225246432 LigandFit 0.00397234073856113 MCSS 4.4137119317345886E-4 MODELER 0.23569221715462704 MesoDyn 7.356186552890981E-4 Mesocite 0.0029424746211563924 Mesoscale 0.005737825511254966 Modules 0.0 Morphology 0.016919229071649257 ONETEP 8.827423863469177E-4 Polymorph 0.0017654847726938355 QMERA 1.4712373105781962E-4 QSAR 7.356186552890981E-4 Quantum Mechanics 0.5046343975283213 Reflex 0.05178755333235251 Reflex Plus 0.0013241135795203766 Semi-empirical 0.006326320435486244 Sorption 0.05708400765043402 Synthia 0.0014712373105781962 TURBOMOLE 2.9424746211563924E-4 VAMP 0.0010298661174047373 Visualization 0.7565102250993085 X-Cell 0.0014712373105781962 ZDOCK 0.028247756363101367

Year

2023 0.1046577196346002 2024 0.4886658396300891 2025 1.0 2026 0.4791925115597158 2027 0.0

Keywords

target 1.0 potential 0.29404223736589974 docking 0.2154375548208623 analysis 0.20511436475271574 visualization 0.18068956210781997 between 0.152081505971257 novel 0.09803656973213683 energy 0.08245057688415086 promising 0.0732069361041765 binding 0.0711153093583429 cell 0.06335604884960529 activity 0.05073881654409284 stability 0.038728830713177245 performance 0.03542271101814992 interaction 0.023615140678766616 synthesized 0.023210309695702043 experimental 0.020578908305782337 including 0.01990419000067472 effective 0.018217394237905676 mechanism 0.01720531678024425 development 0.016598070305647392 protein 0.007759260508737602 enhanced 0.004857971796774847 synthesis 0.002496457728898185 design 0.0
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