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Application

Discovery Studio 0.9363101764178212 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06818181818181818 Amorphous Cell 0.2838915470494418 Blends 0.0025252525252525255 CASTEP 0.4007177033492823 CDOCKER 0.1652046783625731 CHARMm 0.24681020733652312 COMPASS 0.3713450292397661 COMPASS III 0.08187134502923976 COSMObase 0.0033227006911217436 COSMOconf 0.004917597022860181 COSMOmic 1.3290802764486976E-4 COSMOperm 0.0011961722488038277 COSMOplex 3.9872408293460925E-4 COSMOquick 0.001063264221158958 COSMOtherm 0.06685273790536948 Cantera 0.0 Catalyst 0.1177565124933546 Classical Simulations 1.0 Conformers 6.645401382243488E-4 Crystallization 0.07748538011695906 DFTB Plus 0.006113769271664009 DMol3 0.18009037745879852 DPD 0.003189792663476874 Discover 0.0043859649122807015 Forcite 0.5445241892610314 GULP 0.0215311004784689 Kinetix 2.658160552897395E-4 LUDI 0.004917597022860181 LibDock 0.06698564593301436 LigandFit 0.0057150451887293995 MCSS 3.9872408293460925E-4 MODELER 0.18660287081339713 MesoDyn 7.974481658692185E-4 Mesocite 0.003987240829346092 Mesoscale 0.007044125465178097 Morphology 0.018075491759702286 ONETEP 0.0013290802764486975 Polymorph 0.002259436469962786 QMERA 2.658160552897395E-4 QSAR 0.0013290802764486975 Quantum Mechanics 0.5708399787347156 Reflex 0.05635300372142477 Reflex Plus 5.31632110579479E-4 Semi-empirical 0.007974481658692184 Sorption 0.056220095693779906 Synthia 0.0011961722488038277 TURBOMOLE 5.31632110579479E-4 VAMP 0.0013290802764486975 Visualization 0.7941254651780968 X-Cell 0.0013290802764486975 ZDOCK 0.029239766081871343

Year

2021 0.0035861336166821624 2022 0.2014875813521052 2023 0.2888829857882853 2024 0.763580820826139 2025 1.0 2026 0.520387833709656 2027 0.0

Keywords

target 1.0 potential 0.2739887806318276 docking 0.20897549453793918 analysis 0.1914378506052554 visualization 0.1900797165633304 between 0.1522881606141128 novel 0.09565987599645705 energy 0.08768821966341896 binding 0.0684971951579569 cell 0.06454089164452317 promising 0.05839976380277532 activity 0.05137289636846767 stability 0.03578387953941541 experimental 0.03029229406554473 synthesized 0.02863891349276646 interaction 0.0284617655742545 performance 0.028225568349571892 effective 0.020194862710363155 mechanism 0.018541482137584882 including 0.015470918216710953 development 0.015352819604369648 synthesis 0.009802184824328314 protein 0.007971656333038087 design 0.002657218777679362 chemical 0.0
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