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Application

Discovery Studio 1.0 Materials Studio 0.9535899094437258 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05725425815719269 Amorphous Cell 0.27826800738764623 Blends 0.002257336343115124 CASTEP 0.3262877077775498 CDOCKER 0.1752513851836651 CHARMm 0.277241945413503 COMPASS 0.33819002667761133 COMPASS III 0.10240098501949518 COSMObase 0.004719885081058896 COSMOconf 0.005540734660373486 COSMOmic 0.0 COSMOperm 4.104247896572953E-4 COSMOplex 2.0521239482864764E-4 COSMOquick 8.208495793145906E-4 COSMOtherm 0.06320541760722348 Catalyst 0.08598399343320337 Classical Simulations 1.0 Conformers 4.104247896572953E-4 Crystallization 0.07120870100554073 DFTB Plus 0.004309460291401601 DMol3 0.1520623845680279 DPD 0.002257336343115124 Discover 0.004104247896572953 Forcite 0.5206238456802791 GULP 0.017853478350092346 Kinetix 2.0521239482864764E-4 LUDI 0.0038990355017443053 LibDock 0.07346603734865585 LigandFit 0.004309460291401601 MCSS 2.0521239482864764E-4 MODELER 0.26164580340652577 MesoDyn 6.15637184485943E-4 Mesocite 0.002872973527601067 Mesoscale 0.005540734660373486 Modules 0.0 Morphology 0.01662220398112046 ONETEP 0.0010260619741432383 Polymorph 0.002462548737943772 QMERA 2.0521239482864764E-4 QSAR 6.15637184485943E-4 Quantum Mechanics 0.46952595936794583 Reflex 0.05089267391750462 Reflex Plus 8.208495793145906E-4 Semi-empirical 0.005745947055202134 Sorption 0.057049045762364047 Synthia 0.0010260619741432383 TURBOMOLE 2.0521239482864764E-4 VAMP 8.208495793145906E-4 Visualization 0.7315821875641288 X-Cell 0.001231274368971886 ZDOCK 0.028934947670839317

Year

2023 1.658649859014762E-4 2024 0.4765301044949411 2025 1.0 2026 0.6797147122242495 2027 0.0

Keywords

target 1.0 potential 0.30926324017979284 docking 0.23119015047879618 analysis 0.21936681649403947 visualization 0.17275747508305647 between 0.14520226695329294 novel 0.0988860660543287 promising 0.08657416454954074 binding 0.07826851670900918 energy 0.07250341997264022 cell 0.06087551299589603 activity 0.053156146179401995 stability 0.039573969122532734 performance 0.03507914793824506 including 0.023548954465507133 synthesized 0.020031268321282002 development 0.01924956028923197 effective 0.017588430721125658 mechanism 0.015438733632988078 experimental 0.0120187609927692 interaction 0.00908735587258159 enhanced 0.0080125073285128 strong 0.007817080320500294 protein 0.005667383232362712 synthesis 0.0
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