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Application

Discovery Studio 1.0 Materials Studio 0.9651531151003168 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.062418215126930125 Amorphous Cell 0.27649829887464017 Blends 0.0022245485475006544 CASTEP 0.39950274797173513 CDOCKER 0.180188432347553 CHARMm 0.2604030358544884 COMPASS 0.3694059146820204 COMPASS III 0.08348599842973044 COSMObase 0.003140539125883277 COSMOconf 0.0037948181104422926 COSMOmic 1.3085579691180318E-4 COSMOperm 0.0013085579691180318 COSMOplex 3.925673907354096E-4 COSMOquick 9.159905783826224E-4 COSMOtherm 0.065166186862078 Cantera 0.0 Catalyst 0.1189479193928291 Classical Simulations 1.0 Conformers 9.159905783826224E-4 Crystallization 0.07432609264590422 DFTB Plus 0.006935357236325569 DMol3 0.18293640408270087 DPD 0.003140539125883277 Discover 0.004579952891913112 Forcite 0.5290499869144203 GULP 0.025516880397801624 Kinetix 2.6171159382360636E-4 LUDI 0.004579952891913112 LibDock 0.07301753467678618 LigandFit 0.007197068830149176 MCSS 9.159905783826224E-4 MODELER 0.20230306202564774 MesoDyn 0.0011777021722062287 Mesocite 0.003925673907354096 Mesoscale 0.007197068830149176 Modules 0.0 Morphology 0.01792724417691704 ONETEP 9.159905783826224E-4 Polymorph 0.0023554043444124575 QMERA 1.3085579691180318E-4 QSAR 0.0011777021722062287 Quantum Mechanics 0.5705312745354619 Reflex 0.05352002093692751 Reflex Plus 9.159905783826224E-4 Semi-empirical 0.008898194190002618 Sorption 0.055875425281339965 Synthia 0.002093692750588851 TURBOMOLE 3.925673907354096E-4 VAMP 0.0015702695629416384 Visualization 0.8754252813399633 X-Cell 7.851347814708192E-4 ZDOCK 0.03075111227427375

Year

2020 0.0 2021 0.18190757128810225 2022 0.24188790560471976 2023 0.36142716673690123 2024 0.8324202837477174 2025 1.0 2026 0.4645315353279955 2027 2.8093833403567916E-4

Keywords

target 1.0 potential 0.26868990050580843 docking 0.2194986382079929 visualization 0.21132788616530487 analysis 0.18342504585626146 between 0.14807403701850924 novel 0.09916069145683953 energy 0.08176310377410928 binding 0.06970151742537936 cell 0.058529264632316155 activity 0.05513868045133678 promising 0.05102551275637819 interaction 0.03562892557389806 synthesized 0.03068200767050192 experimental 0.02845867378133511 stability 0.02673559001723084 development 0.01956533822466789 protein 0.018509254627313655 performance 0.017453171029959424 mechanism 0.01611917069645934 effective 0.01584125396031349 synthesis 0.011561336223667389 including 0.011227836140292368 chemical 4.446667778333611E-4 design 0.0
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