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Application

Discovery Studio 0.8281728172817282 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06842041752141909 Amorphous Cell 0.289248220103777 Blends 0.0026547604682032096 CASTEP 0.39435260045854953 CDOCKER 0.14589115482080367 CHARMm 0.23313623748039097 COMPASS 0.3662362736816701 COMPASS III 0.0935199710389767 COSMObase 0.004223482563050561 COSMOconf 0.004826837214914927 COSMOmic 1.2067093037287318E-4 COSMOperm 0.0013273802341016048 COSMOplex 1.2067093037287318E-4 COSMOquick 0.0015687220948473514 COSMOtherm 0.06552431519247014 Cantera 0.0 Catalyst 0.09026185591890913 Classical Simulations 1.0 Conformers 7.240255822372391E-4 Crystallization 0.07348859659707976 DFTB Plus 0.005912875588270786 DMol3 0.17569687462290334 DPD 0.0026547604682032096 Discover 0.0036201279111861954 Forcite 0.5550862797152166 GULP 0.023289489561964524 Kinetix 2.4134186074574636E-4 LUDI 0.0030167732593218296 LibDock 0.061662845420538195 LigandFit 0.0037407988415590686 MCSS 3.6201279111861955E-4 MODELER 0.20465789791239292 MesoDyn 9.653674429829854E-4 Mesocite 0.003258115120067576 Mesoscale 0.006395559309762279 Modules 0.0 Morphology 0.017376613973693736 ONETEP 0.0012067093037287317 Polymorph 0.002051405816338844 QMERA 1.2067093037287318E-4 QSAR 9.653674429829854E-4 Quantum Mechanics 0.558465065765657 Reflex 0.053336551224809944 Reflex Plus 0.0010860383733558585 Semi-empirical 0.007481597683118137 Sorption 0.059128755882707856 Synthia 0.0013273802341016048 TURBOMOLE 4.826837214914927E-4 VAMP 0.0012067093037287317 Visualization 0.6962712682514782 X-Cell 0.0015687220948473514 ZDOCK 0.024134186074574637

Year

2023 0.12326169405815424 2024 0.47607007404731805 2025 1.0 2026 0.38378183131659743 2027 0.0

Keywords

target 1.0 potential 0.2853830930166808 analysis 0.19604184337008765 docking 0.1907266044670625 visualization 0.16443313542550184 between 0.15985298275374613 energy 0.09968900197907832 novel 0.09725756290641786 promising 0.07011591744416172 cell 0.06904156064461409 binding 0.059033078880407125 performance 0.047271699180096126 stability 0.042352275940062196 activity 0.04161718970879276 experimental 0.03194797851286401 interaction 0.024879841673734804 synthesized 0.02329657902176986 including 0.02075204975968335 effective 0.02046932428611818 mechanism 0.017755159739892563 development 0.0176420695504665 enhanced 0.009838846480067854 design 0.0031099802092168505 synthesis 0.0030534351145038168 protein 0.0
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