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Application

Discovery Studio 1.0 Materials Studio 0.9042196918955124 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05828308929084123 Amorphous Cell 0.2698822853861614 Blends 0.0020097616996841805 CASTEP 0.3051966695377548 CDOCKER 0.17685902957220787 CHARMm 0.28883146712604074 COMPASS 0.33189778926213037 COMPASS III 0.10335917312661498 COSMObase 0.004880849842090152 COSMOconf 0.006316393913293138 COSMOmic 0.0 COSMOperm 5.742176284811944E-4 COSMOplex 2.871088142405972E-4 COSMOquick 8.613264427217916E-4 COSMOtherm 0.0611541774332472 Catalyst 0.07895492391616422 Classical Simulations 1.0 Conformers 2.871088142405972E-4 Crystallization 0.07292563881711168 DFTB Plus 0.002871088142405972 DMol3 0.14125753660637383 DPD 0.0017226528854435831 Discover 0.00516795865633075 Forcite 0.5116279069767442 GULP 0.014929658340511054 Kinetix 0.0 LUDI 0.004880849842090152 LibDock 0.07436118288831467 LigandFit 0.004306632213608958 MCSS 2.871088142405972E-4 MODELER 0.2741889175997703 MesoDyn 5.742176284811944E-4 Mesocite 0.002871088142405972 Mesoscale 0.00516795865633075 Morphology 0.016652311225954636 ONETEP 5.742176284811944E-4 Polymorph 0.0022968705139247776 QMERA 2.871088142405972E-4 QSAR 2.871088142405972E-4 Quantum Mechanics 0.43784094171691074 Reflex 0.05282802182026988 Reflex Plus 5.742176284811944E-4 Semi-empirical 0.004593741027849555 Sorption 0.05627332759115705 Synthia 5.742176284811944E-4 TURBOMOLE 0.0 VAMP 8.613264427217916E-4 Visualization 0.7232271030720643 X-Cell 0.001435544071202986 ZDOCK 0.031007751937984496

Year

2024 0.288107202680067 2025 1.0 2026 0.9066762383345298 2027 0.0

Keywords

target 1.0 potential 0.3232294210601925 docking 0.24436144232150553 analysis 0.22942106019250108 visualization 0.17382559977014797 between 0.1374802470909352 novel 0.09524493607240339 promising 0.09409567590863381 binding 0.08878034765119953 energy 0.06134176124120098 cell 0.05545180290188191 activity 0.04941818704209165 stability 0.04008044821146387 including 0.025283723602930613 performance 0.024709093521045826 strong 0.019968395345496336 development 0.014365752047119667 effective 0.013072834362878897 mechanism 0.009768711392041373 synthesized 0.009194081310156586 enhanced 0.0061772733802614565 interaction 0.002011205286596753 protein 0.002011205286596753 therapeutic 0.0011492601637695732 experimental 0.0
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