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Application

Discovery Studio 1.0 Materials Studio 0.9536030483021405 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06762633078422552 Amorphous Cell 0.2741040635777478 Blends 0.002399160293897136 CASTEP 0.37411905832958464 CDOCKER 0.17768780926675665 CHARMm 0.2741040635777478 COMPASS 0.353726195831459 COMPASS III 0.07722297195981406 COSMObase 0.002699055330634278 COSMOconf 0.004048582995951417 COSMOmic 2.99895036737142E-4 COSMOperm 0.001199580146948568 COSMOplex 2.99895036737142E-4 COSMOquick 0.001349527665317139 COSMOtherm 0.0599790073474284 Cantera 0.0 Catalyst 0.12280701754385964 Classical Simulations 1.0 Conformers 0.001349527665317139 Crystallization 0.07407407407407407 DFTB Plus 0.003748687959214275 DMol3 0.1685410106462738 DPD 0.002549107812265707 Discover 0.003898635477582846 Forcite 0.5272154745838956 GULP 0.022642075273654222 Kinetix 1.49947518368571E-4 LUDI 0.005847953216374269 LibDock 0.0724246513720198 LigandFit 0.006597690808217124 MCSS 0.001199580146948568 MODELER 0.19418203628729944 MesoDyn 0.00149947518368571 Mesocite 0.003898635477582846 Mesoscale 0.007197480881691408 Morphology 0.016794122057279953 ONETEP 0.001049632628579997 Polymorph 0.001349527665317139 QMERA 1.49947518368571E-4 QSAR 7.49737591842855E-4 Quantum Mechanics 0.5324636377267956 Reflex 0.0553306342780027 Reflex Plus 2.99895036737142E-4 Semi-empirical 0.005398110661268556 Sorption 0.05278152646573699 Synthia 5.99790073474284E-4 TURBOMOLE 5.99790073474284E-4 VAMP 0.001199580146948568 Visualization 0.8344579397210976 X-Cell 0.001349527665317139 ZDOCK 0.030439346228819913

Year

2021 0.004846756949394155 2022 0.21325730577334284 2023 0.3074839629365645 2024 0.6905203136136849 2025 1.0 2026 0.4369208838203849 2027 0.0

Keywords

target 1.0 potential 0.2837890880544289 docking 0.2286405861572681 visualization 0.20692136595577654 analysis 0.19318330498495356 between 0.15059531597540232 novel 0.10696061755855031 binding 0.08079288237603036 energy 0.07968075363077326 cell 0.06188669370665969 promising 0.057961533429281696 activity 0.0558681146146801 interaction 0.037877796676697634 stability 0.03755069998691613 synthesized 0.02793405730734005 experimental 0.023812639016093158 performance 0.023223864974486457 mechanism 0.02302760696061756 effective 0.022962187622661258 protein 0.02243883291901086 including 0.02034541410440926 development 0.019887478738715166 synthesis 0.014326835012429675 design 0.004383095643072092 chemical 0.0
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